3-(6,8-dinitro-2-oxidanylidene-chromen-3-yl)sulfonyl-6,8-dinitro-chromen-2-one

Systemtic Name: 3-(6,8-dinitro-2-oxidanylidene-chromen-3-yl)sulfonyl-6,8-dinitro-chromen-2-one Openeye Name: 3-(6,8-dinitro-2-oxo-chromen-3-yl)sulfonyl-6,8-dinitro-chromen-2-one CAS Name: 3-[(6,8-dinitro-2-oxo-1-benzopyran-3-yl)sulfonyl]-6,8-dinitro-1-benzopyran-2-one IUPAC Name: 3-(6,8-dinitro-2-oxochromen-3-yl)sulfonyl-6,8-dinitrochromen-2-one Traditional Name: 3-(2-keto-6,8-dinitro-chromen-3-yl)sulfonyl-6,8-dinitro-coumarin Formula: C18H6N4O14S MolecularWeight: 534.32364

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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)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)C3=CC4=CC(=CC(=C4OC3=O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H6N4O14S/c23-17-13(3-7-1-9(19(25)26)5-11(21(29)30)15(7)35-17)37(33,34)14-4-8-2-10(20(27)28)6-12(22(31)32)16(8)36-18(14)24/h1-6H