(4-bromophenyl)methyl 4-naphthalen-2-yl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-6-carboxylate

Systemtic Name: (4-bromophenyl)methyl 4-naphthalen-2-yl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-6-carboxylate Openeye Name: (4-bromophenyl)methyl 4-(2-naphthyl)-2-oxo-3,4-dihydro-1H-pyrimidine-6-carboxylate CAS Name: 4-(2-naphthalenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-6-carboxylic acid (4-bromophenyl)methyl ester IUPAC Name: (4-bromophenyl)methyl 4-naphthalen-2-yl-2-oxo-3,4-dihydro-1H-pyrimidine-6-carboxylate Traditional Name: 2-keto-4-(2-naphthyl)-3,4-dihydro-1H-pyrimidine-6-carboxylic acid (4-bromobenzyl) ester Formula: C22H17BrN2O3 MolecularWeight: 437.28598

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)C3C=C(NC(=O)N3)C(=O)OCC4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)C3C=C(NC(=O)N3)C(=O)OCC4=CC=C(C=C4)Br

InChI

InChI=1S/C22H17BrN2O3/c23-18-9-5-14(6-10-18)13-28-21(26)20-12-19(24-22(27)25-20)17-8-7-15-3-1-2-4-16(15)11-17/h1-12,19H,13H2,(H2,24,25,27)