(4-bromophenyl) (3S)-1-(3-chloranyl-4-methyl-phenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: (4-bromophenyl) (3S)-1-(3-chloranyl-4-methyl-phenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: (4-bromophenyl) (3S)-1-(3-chloro-4-methyl-phenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-(3-chloro-4-methylphenyl)-5-oxo-3-pyrrolidinecarboxylic acid (4-bromophenyl) ester IUPAC Name: (4-bromophenyl) (3S)-1-(3-chloro-4-methylphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-1-(3-chloro-4-methyl-phenyl)-5-keto-pyrrolidine-3-carboxylic acid (4-bromophenyl) ester Formula: C18H15BrClNO3 MolecularWeight: 408.6736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2CC(CC2=O)C(=O)OC3=CC=C(C=C3)Br)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C[C@H](CC2=O)C(=O)OC3=CC=C(C=C3)Br)Cl

InChI

InChI=1S/C18H15BrClNO3/c1-11-2-5-14(9-16(11)20)21-10-12(8-17(21)22)18(23)24-15-6-3-13(19)4-7-15/h2-7,9,12H,8,10H2,1H3/t12-/m0/s1