(4-oxidanylidene-3-phenyl-chromen-7-yl) 4-methyl-3,5-dinitro-benzoate

Systemtic Name: (4-oxidanylidene-3-phenyl-chromen-7-yl) 4-methyl-3,5-dinitro-benzoate Openeye Name: (4-oxo-3-phenyl-chromen-7-yl) 4-methyl-3,5-dinitro-benzoate CAS Name: 4-methyl-3,5-dinitrobenzoic acid (4-oxo-3-phenyl-1-benzopyran-7-yl) ester IUPAC Name: (4-oxo-3-phenylchromen-7-yl) 4-methyl-3,5-dinitrobenzoate Traditional Name: 4-methyl-3,5-dinitro-benzoic acid (4-keto-3-phenyl-chromen-7-yl) ester Formula: C23H14N2O8 MolecularWeight: 446.36586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])C(=O)OC2=CC3=C(C=C2)C(=O)C(=CO3)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])C(=O)OC2=CC3=C(C=C2)C(=O)C(=CO3)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H14N2O8/c1-13-19(24(28)29)9-15(10-20(13)25(30)31)23(27)33-16-7-8-17-21(11-16)32-12-18(22(17)26)14-5-3-2-4-6-14/h2-12H,1H3