(phenylmethyl) 1,6-dimethyl-4-(3-nitrophenyl)-2-oxidanylidene-pyrimidine-5-carboxylate

Systemtic Name: (phenylmethyl) 1,6-dimethyl-4-(3-nitrophenyl)-2-oxidanylidene-pyrimidine-5-carboxylate Openeye Name: benzyl 1,6-dimethyl-4-(3-nitrophenyl)-2-oxo-pyrimidine-5-carboxylate CAS Name: 1,6-dimethyl-4-(3-nitrophenyl)-2-oxo-5-pyrimidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 1,6-dimethyl-4-(3-nitrophenyl)-2-oxopyrimidine-5-carboxylate Traditional Name: 2-keto-1,6-dimethyl-4-(3-nitrophenyl)pyrimidine-5-carboxylic acid benzyl ester Formula: C20H17N3O5 MolecularWeight: 379.36608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=O)N1C)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=NC(=O)N1C)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C20H17N3O5/c1-13-17(19(24)28-12-14-7-4-3-5-8-14)18(21-20(25)22(13)2)15-9-6-10-16(11-15)23(26)27/h3-11H,12H2,1-2H3