[1-(6-methyl-5-nitro-2-oxidanylidene-3,4-dihydro-1H-pyrimidin-4-yl)naphthalen-2-yl] benzoate

Systemtic Name: [1-(6-methyl-5-nitro-2-oxidanylidene-3,4-dihydro-1H-pyrimidin-4-yl)naphthalen-2-yl] benzoate Openeye Name: [1-(6-methyl-5-nitro-2-oxo-3,4-dihydro-1H-pyrimidin-4-yl)-2-naphthyl] benzoate CAS Name: benzoic acid [1-(6-methyl-5-nitro-2-oxo-3,4-dihydro-1H-pyrimidin-4-yl)-2-naphthalenyl] ester IUPAC Name: [1-(6-methyl-5-nitro-2-oxo-3,4-dihydro-1H-pyrimidin-4-yl)naphthalen-2-yl] benzoate Traditional Name: benzoic acid [1-(2-keto-6-methyl-5-nitro-3,4-dihydro-1H-pyrimidin-4-yl)-2-naphthyl] ester Formula: C22H17N3O5 MolecularWeight: 403.38748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1)C2=C(C=CC3=CC=CC=C32)OC(=O)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(NC(=O)N1)C2=C(C=CC3=CC=CC=C32)OC(=O)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H17N3O5/c1-13-20(25(28)29)19(24-22(27)23-13)18-16-10-6-5-7-14(16)11-12-17(18)30-21(26)15-8-3-2-4-9-15/h2-12,19H,1H3,(H2,23,24,27)