[2-(4-methoxyphenyl)-4-oxidanylidene-chromen-6-yl] 4-methyl-3,5-dinitro-benzoate

Systemtic Name: [2-(4-methoxyphenyl)-4-oxidanylidene-chromen-6-yl] 4-methyl-3,5-dinitro-benzoate Openeye Name: [2-(4-methoxyphenyl)-4-oxo-chromen-6-yl] 4-methyl-3,5-dinitro-benzoate CAS Name: 4-methyl-3,5-dinitrobenzoic acid [2-(4-methoxyphenyl)-4-oxo-1-benzopyran-6-yl] ester IUPAC Name: [2-(4-methoxyphenyl)-4-oxochromen-6-yl] 4-methyl-3,5-dinitrobenzoate Traditional Name: 4-methyl-3,5-dinitro-benzoic acid [4-keto-2-(4-methoxyphenyl)chromen-6-yl] ester Formula: C24H16N2O9 MolecularWeight: 476.39184

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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)OC(=CC3=O)C4=CC=C(C=C4)OC)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C24H16N2O9/c1-13-19(25(29)30)9-15(10-20(13)26(31)32)24(28)34-17-7-8-22-18(11-17)21(27)12-23(35-22)14-3-5-16(33-2)6-4-14/h3-12H,1-2H3