(3S)-1-(4-methoxyphenyl)-5-oxidanylidene-N-[2-(4-phenylpiperazin-1-yl)carbonylphenyl]pyrrolidine-3-carboxamide

Systemtic Name: (3S)-1-(4-methoxyphenyl)-5-oxidanylidene-N-[2-(4-phenylpiperazin-1-yl)carbonylphenyl]pyrrolidine-3-carboxamide Openeye Name: (3S)-1-(4-methoxyphenyl)-5-oxo-N-[2-(4-phenylpiperazine-1-carbonyl)phenyl]pyrrolidine-3-carboxamide CAS Name: (3S)-1-(4-methoxyphenyl)-5-oxo-N-[2-[oxo-(4-phenyl-1-piperazinyl)methyl]phenyl]-3-pyrrolidinecarboxamide IUPAC Name: (3S)-1-(4-methoxyphenyl)-5-oxo-N-[2-(4-phenylpiperazine-1-carbonyl)phenyl]pyrrolidine-3-carboxamide Traditional Name: (3S)-5-keto-1-(4-methoxyphenyl)-N-[2-(4-phenylpiperazine-1-carbonyl)phenyl]pyrrolidine-3-carboxamide Formula: C29H30N4O4 MolecularWeight: 498.5729

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NC3=CC=CC=C3C(=O)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)N2C[C@H](CC2=O)C(=O)NC3=CC=CC=C3C(=O)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C29H30N4O4/c1-37-24-13-11-23(12-14-24)33-20-21(19-27(33)34)28(35)30-26-10-6-5-9-25(26)29(36)32-17-15-31(16-18-32)22-7-3-2-4-8-22/h2-14,21H,15-20H2,1H3,(H,30,35)/t21-/m0/s1