[2-(4-methylphenyl)-4-oxidanylidene-chromen-3-yl] 4-nitrobenzoate

Systemtic Name: [2-(4-methylphenyl)-4-oxidanylidene-chromen-3-yl] 4-nitrobenzoate Openeye Name: [4-oxo-2-(p-tolyl)chromen-3-yl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [2-(4-methylphenyl)-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [2-(4-methylphenyl)-4-oxochromen-3-yl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [4-keto-2-(p-tolyl)chromen-3-yl] ester Formula: C23H15NO6 MolecularWeight: 401.3683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=O)C3=CC=CC=C3O2)OC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=O)C3=CC=CC=C3O2)OC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H15NO6/c1-14-6-8-15(9-7-14)21-22(20(25)18-4-2-3-5-19(18)29-21)30-23(26)16-10-12-17(13-11-16)24(27)28/h2-13H,1H3