[1-(3,4-dimethyl-5-nitro-2-oxidanylidene-1,6-dihydropyrimidin-6-yl)naphthalen-2-yl] benzoate

Systemtic Name: [1-(3,4-dimethyl-5-nitro-2-oxidanylidene-1,6-dihydropyrimidin-6-yl)naphthalen-2-yl] benzoate Openeye Name: [1-(3,4-dimethyl-5-nitro-2-oxo-1,6-dihydropyrimidin-6-yl)-2-naphthyl] benzoate CAS Name: benzoic acid [1-(3,4-dimethyl-5-nitro-2-oxo-1,6-dihydropyrimidin-6-yl)-2-naphthalenyl] ester IUPAC Name: [1-(3,4-dimethyl-5-nitro-2-oxo-1,6-dihydropyrimidin-6-yl)naphthalen-2-yl] benzoate Traditional Name: benzoic acid [1-(2-keto-3,4-dimethyl-5-nitro-1,6-dihydropyrimidin-6-yl)-2-naphthyl] ester Formula: C23H19N3O5 MolecularWeight: 417.41406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1C)C2=C(C=CC3=CC=CC=C32)OC(=O)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(NC(=O)N1C)C2=C(C=CC3=CC=CC=C32)OC(=O)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H19N3O5/c1-14-21(26(29)30)20(24-23(28)25(14)2)19-17-11-7-6-8-15(17)12-13-18(19)31-22(27)16-9-4-3-5-10-16/h3-13,20H,1-2H3,(H,24,28)