[3-(3-methylphenoxy)-4-oxidanylidene-chromen-7-yl] 4-methyl-3,5-dinitro-benzoate

Systemtic Name: [3-(3-methylphenoxy)-4-oxidanylidene-chromen-7-yl] 4-methyl-3,5-dinitro-benzoate Openeye Name: [3-(3-methylphenoxy)-4-oxo-chromen-7-yl] 4-methyl-3,5-dinitro-benzoate CAS Name: 4-methyl-3,5-dinitrobenzoic acid [3-(3-methylphenoxy)-4-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(3-methylphenoxy)-4-oxochromen-7-yl] 4-methyl-3,5-dinitrobenzoate Traditional Name: 4-methyl-3,5-dinitro-benzoic acid [4-keto-3-(3-methylphenoxy)chromen-7-yl] ester Formula: C24H16N2O9 MolecularWeight: 476.39184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC2=COC3=C(C2=O)C=CC(=C3)OC(=O)C4=CC(=C(C(=C4)[N+](=O)[O-])C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)OC2=COC3=C(C2=O)C=CC(=C3)OC(=O)C4=CC(=C(C(=C4)[N+](=O)[O-])C)[N+](=O)[O-]

InChI

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