Chem
J-GLOBAL ID:200907055405984678
Nikkaji number:J1.822.651K
2-(4-Chlorophenoxymethyl)-3-(4-chlorophenoxy)-4-amino-7-nitropyrimido[1,2-a]indole-10-carbaldehyde
2-(4-クロロフェノキシメチル)-3-(4-クロロフェノキシ)-4-アミノ-7-ニトロピリミド[1,2-a]インドール-10-カルボアルデヒド
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Substance type:
Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula:
C25 H16 Cl2 N3 [N+]O4 [O-]
Molecular formula furigana:
C25-H16-CL2-N4-O5
Molecular weight:
523.330
InChI:
InChI=1S/C25H16Cl2N4O5/c26-14-1-6-17(7-2-14)35-13-21-23(36-18-8-3-15(27)4-9-18)24(28)30-22-11-16(31(33)34)5-10-19(22)20(12-32)25(30)29-21/h1-12H,13,28H2
InChI key:
MUPKSWNCCABSKJ-UHFFFAOYSA-N
SMILES:
Nc1c(Oc2ccc(Cl)cc2)c(COc2ccc(Cl)cc2)nc2c(C=O)c3ccc(cc3n12)[N+](=O)[O-]
Systematic name (4):
2-(4-クロロフェノキシメチル)-3-(4-クロロフェノキシ)-4-アミノ-7-ニトロピリミド[1,2-a]インドール-10-カルボアルデヒド
2-[(4-クロロフェノキシ)メチル]-3-(4-クロロフェノキシ)-4-アミノ-7-ニトロピリミド[1,2-a]インドール-10-カルボアルデヒド
4-アミノ-3-(4-クロロフェノキシ)-2-[(4-クロロフェノキシ)メチル]-7-ニトロピリミド[1,2-a]インドール-10-カルバルデヒド
4-amino-3-(4-chlorophenoxy)-2-[(4-chlorophenoxy)methyl]-7-nitropyrimido[1,2-a]indole-10-carbaldehyde
Other name (2):
2-(4-Chlorophenoxymethyl)-3-(4-chlorophenoxy)-4-amino-7-nitropyrimido[1,2-a]indole-10-carbaldehyde
2-[(4-Chlorophenoxy)methyl]-3-(4-chlorophenoxy)-4-amino-7-nitropyrimido[1,2-a]indole-10-carbaldehyde
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