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3-[(6,8-dinitro-2-oxidanylidene-chromen-3-yl)sulfonylmethylsulfonyl]-6,8-dinitro-chromen-2-one
3-[(6,8-dinitro-2-oxidanylidene-chromen-3-yl)sulfonylmethylsulfonyl]-6,8-dinitro-chromen-2-one
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Descriptors Computed from Structure
Canonical SMILES:
C1=C2C=C(C(=O)OC2=C(C=C1[N+](=O)[O-])[N+](=O)[O-])S(=O)(=O)CS(=O)(=O)C3=CC4=CC(=CC(=C4OC3=O)[N+](=O)[O-])[N+](=O)[O-]
Isomeric SMILES
C1=C2C=C(C(=O)OC2=C(C=C1[N+](=O)[O-])[N+](=O)[O-])S(=O)(=O)CS(=O)(=O)C3=CC4=CC(=CC(=C4OC3=O)[N+](=O)[O-])[N+](=O)[O-]
InChI
InChI=1S/C19H8N4O16S2/c24-18-14(3-8-1-10(20(26)27)5-12(22(30)31)16(8)38-18)40(34,35)7-41(36,37)15-4-9-2-11(21(28)29)6-13(23(32)33)17(9)39-19(15)25/h1-6H,7H2
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