Chem
J-GLOBAL ID:201907004818698120
Nikkaji number:J3.735.384A
3',6'-dihydroxy-4',5'-diiodo-2',5,7'-trinitrospiro[2-benzofuran-1,9'-xanthen]-3-one
3',6'-ジヒドロキシ-4',5'-ジヨード-2',5,7'-トリニトロスピロ[2-ベンゾフラン-1,9'-キサンテン]-3-オン
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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:
C20 H7 I2 N3 O11
Molecular formula furigana:
C20-H7-I2-N3-O11
Molecular weight:
719.095
InChI:
InChI=1S/C20H7I2N3O11/c21-13-15(26)11(24(31)32)4-9-17(13)35-18-10(5-12(25(33)34)16(27)14(18)22)20(9)8-2-1-6(23(29)30)3-7(8)19(28)36-20/h1-5,26-27H
InChI key:
LCCPHRMEQSLSBU-UHFFFAOYSA-N
SMILES:
Oc1c(cc2c(Oc3c(cc(c(O)c3I)[N+](=O)[O-])C32OC(=O)c2cc(ccc32)[N+](=O)[O-])c1I)[N+](=O)[O-]
Systematic name (3):
4,5-ジヨード-2,6′,7-トリニトロ-3,6-ジヒドロキシスピロ[9H-キサンテン-9,1′(3′H)-イソベンゾフラン]-3′-オン
3',6'-ジヒドロキシ-4',5'-ジヨード-2',5,7'-トリニトロ-3H-スピロ[2-ベンゾフラン-1,9'-キサンテン]-3-オン
3',6'-dihydroxy-4',5'-diiodo-2',5,7'-trinitro-3H-spiro[2-benzofuran-1,9'-xanthen]-3-one
Other name (2):
3',6'-ジヒドロキシ-4',5'-ジヨード-2',5,7'-トリニトロスピロ[2-ベンゾフラン-1,9'-キサンテン]-3-オン
3',6'-dihydroxy-4',5'-diiodo-2',5,7'-trinitrospiro[2-benzofuran-1,9'-xanthen]-3-one
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