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

Systemtic Name: (4-methylphenyl)methyl (4S)-4-(4-bromophenyl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyridine-5-carboxylate Openeye Name: p-tolylmethyl (4S)-4-(4-bromophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxylate CAS Name: (4S)-4-(4-bromophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxylic acid (4-methylphenyl)methyl ester IUPAC Name: (4-methylphenyl)methyl (4S)-4-(4-bromophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxylate Traditional Name: (4S)-4-(4-bromophenyl)-2-keto-6-methyl-3,4-dihydro-1H-pyridine-5-carboxylic acid (4-methylbenzyl) ester Formula: C21H20BrNO3 MolecularWeight: 414.2924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC(=O)C2=C(NC(=O)CC2C3=CC=C(C=C3)Br)C

Isomeric SMILES

CC1=CC=C(C=C1)COC(=O)C2=C(NC(=O)C[C@H]2C3=CC=C(C=C3)Br)C

InChI

InChI=1S/C21H20BrNO3/c1-13-3-5-15(6-4-13)12-26-21(25)20-14(2)23-19(24)11-18(20)16-7-9-17(22)10-8-16/h3-10,18H,11-12H2,1-2H3,(H,23,24)/t18-/m0/s1