[2-(2-chlorophenyl)-6,7-dimethyl-4-oxidanylidene-chromen-3-yl] 3-nitrobenzoate

Systemtic Name: [2-(2-chlorophenyl)-6,7-dimethyl-4-oxidanylidene-chromen-3-yl] 3-nitrobenzoate Openeye Name: [2-(2-chlorophenyl)-6,7-dimethyl-4-oxo-chromen-3-yl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [2-(2-chlorophenyl)-6,7-dimethyl-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [2-(2-chlorophenyl)-6,7-dimethyl-4-oxochromen-3-yl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [2-(2-chlorophenyl)-4-keto-6,7-dimethyl-chromen-3-yl] ester Formula: C24H16ClNO6 MolecularWeight: 449.83994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=O)C(=C(O2)C3=CC=CC=C3Cl)OC(=O)C4=CC(=CC=C4)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=O)C(=C(O2)C3=CC=CC=C3Cl)OC(=O)C4=CC(=CC=C4)[N+](=O)[O-])C

InChI

InChI=1S/C24H16ClNO6/c1-13-10-18-20(11-14(13)2)31-22(17-8-3-4-9-19(17)25)23(21(18)27)32-24(28)15-6-5-7-16(12-15)26(29)30/h3-12H,1-2H3