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

Systemtic Name: 3-phenylpropyl (4R)-4-(2-bromophenyl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyridine-5-carboxylate Openeye Name: 3-phenylpropyl (4R)-4-(2-bromophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxylate CAS Name: (4R)-4-(2-bromophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxylic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl (4R)-4-(2-bromophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxylate Traditional Name: (4R)-4-(2-bromophenyl)-2-keto-6-methyl-3,4-dihydro-1H-pyridine-5-carboxylic acid 3-phenylpropyl ester Formula: C22H22BrNO3 MolecularWeight: 428.31898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CC(=O)N1)C2=CC=CC=C2Br)C(=O)OCCCC3=CC=CC=C3

Isomeric SMILES

CC1=C([C@@H](CC(=O)N1)C2=CC=CC=C2Br)C(=O)OCCCC3=CC=CC=C3

InChI

InChI=1S/C22H22BrNO3/c1-15-21(22(26)27-13-7-10-16-8-3-2-4-9-16)18(14-20(25)24-15)17-11-5-6-12-19(17)23/h2-6,8-9,11-12,18H,7,10,13-14H2,1H3,(H,24,25)/t18-/m0/s1