Chem
J-GLOBAL ID:200907035875895387
Nikkaji number:J1.848.016F
1-[3-(4-Oxazolyl)propyl]-4-methoxy-1,2-dihydrobenzocyclobutene-1-carbonitrile
1-[3-(4-オキサゾリル)プロピル]-4-メトキシ-1,2-ジヒドロベンゾシクロブテン-1-カルボニトリル
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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:
C16 H16 N2 O2
Molecular formula furigana:
C16-H16-N2-O2
Molecular weight:
268.316
InChI:
InChI=1S/C16H16N2O2/c1-19-14-4-5-15-12(7-14)8-16(15,10-17)6-2-3-13-9-20-11-18-13/h4-5,7,9,11H,2-3,6,8H2,1H3
InChI key:
AGWFKLGHVJBMJV-UHFFFAOYSA-N
SMILES:
COc1ccc2c(CC2(CCCc2cocn2)C#N)c1
Systematic name (4):
1-[3-(4-オキサゾリル)プロピル]-4-メトキシ-1,2-ジヒドロベンゾシクロブテン-1-カルボニトリル
3-メトキシ-7-[3-(オキサゾール-4-イル)プロピル]ビシクロ[4.2.0]オクタ-1(6),2,4-トリエン-7-カルボニトリル
3-メトキシ-7-[3-(1,3-オキサゾール-4-イル)プロピル]ビシクロ[4.2.0]オクタ-1,3,5-トリエン-7-カルボニトリル
3-methoxy-7-[3-(1,3-oxazol-4-yl)propyl]bicyclo[4.2.0]octa-1,3,5-triene-7-carbonitrile
Other name (2):
1-[3-(4-Oxazolyl)propyl]-4-methoxy-1,2-dihydrobenzocyclobutene-1-carbonitrile
3-Methoxy-7-[3-(oxazole-4-yl)propyl]bicyclo[4.2.0]octa-1(6),2,4-triene-7-carbonitrile
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