N-(5-chloranyl-2-methyl-phenyl)-1-[(3S)-1-(4-methylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonyl-piperidine-4-carboxamide

Systemtic Name: N-(5-chloranyl-2-methyl-phenyl)-1-[(3S)-1-(4-methylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonyl-piperidine-4-carboxamide Openeye Name: N-(5-chloro-2-methyl-phenyl)-1-[(3S)-5-oxo-1-(p-tolyl)pyrrolidine-3-carbonyl]piperidine-4-carboxamide CAS Name: N-(5-chloro-2-methylphenyl)-1-[[(3S)-1-(4-methylphenyl)-5-oxo-3-pyrrolidinyl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-(5-chloro-2-methylphenyl)-1-[(3S)-1-(4-methylphenyl)-5-oxopyrrolidine-3-carbonyl]piperidine-4-carboxamide Traditional Name: N-(5-chloro-2-methyl-phenyl)-1-[(3S)-5-keto-1-(p-tolyl)pyrrolidine-3-carbonyl]isonipecotamide Formula: C25H28ClN3O3 MolecularWeight: 453.96112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CC(CC2=O)C(=O)N3CCC(CC3)C(=O)NC4=C(C=CC(=C4)Cl)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C[C@H](CC2=O)C(=O)N3CCC(CC3)C(=O)NC4=C(C=CC(=C4)Cl)C

InChI

InChI=1S/C25H28ClN3O3/c1-16-3-7-21(8-4-16)29-15-19(13-23(29)30)25(32)28-11-9-18(10-12-28)24(31)27-22-14-20(26)6-5-17(22)2/h3-8,14,18-19H,9-13,15H2,1-2H3,(H,27,31)/t19-/m0/s1