[6-chloranyl-2-(4-methylphenyl)-4-oxidanylidene-chromen-3-yl] 4-chloranyl-3-nitro-benzoate

Systemtic Name: [6-chloranyl-2-(4-methylphenyl)-4-oxidanylidene-chromen-3-yl] 4-chloranyl-3-nitro-benzoate Openeye Name: [6-chloro-4-oxo-2-(p-tolyl)chromen-3-yl] 4-chloro-3-nitro-benzoate CAS Name: 4-chloro-3-nitrobenzoic acid [6-chloro-2-(4-methylphenyl)-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [6-chloro-2-(4-methylphenyl)-4-oxochromen-3-yl] 4-chloro-3-nitrobenzoate Traditional Name: 4-chloro-3-nitro-benzoic acid [6-chloro-4-keto-2-(p-tolyl)chromen-3-yl] ester Formula: C23H13Cl2NO6 MolecularWeight: 470.25842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=O)C3=C(O2)C=CC(=C3)Cl)OC(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=O)C3=C(O2)C=CC(=C3)Cl)OC(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C23H13Cl2NO6/c1-12-2-4-13(5-3-12)21-22(20(27)16-11-15(24)7-9-19(16)31-21)32-23(28)14-6-8-17(25)18(10-14)26(29)30/h2-11H,1H3