(phenylmethyl) 4-(2-bromophenyl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyridine-5-carboxylate

Systemtic Name: (phenylmethyl) 4-(2-bromophenyl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyridine-5-carboxylate Openeye Name: benzyl 4-(2-bromophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxylate CAS Name: 4-(2-bromophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-(2-bromophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxylate Traditional Name: 4-(2-bromophenyl)-2-keto-6-methyl-3,4-dihydro-1H-pyridine-5-carboxylic acid benzyl ester Formula: C20H18BrNO3 MolecularWeight: 400.26582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CC(=O)N1)C2=CC=CC=C2Br)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(CC(=O)N1)C2=CC=CC=C2Br)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C20H18BrNO3/c1-13-19(20(24)25-12-14-7-3-2-4-8-14)16(11-18(23)22-13)15-9-5-6-10-17(15)21/h2-10,16H,11-12H2,1H3,(H,22,23)