N-(2-ethyl-6-methyl-phenyl)-1-[(3S)-1-(4-methylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonyl-piperidine-4-carboxamide

Systemtic Name: N-(2-ethyl-6-methyl-phenyl)-1-[(3S)-1-(4-methylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonyl-piperidine-4-carboxamide Openeye Name: N-(2-ethyl-6-methyl-phenyl)-1-[(3S)-5-oxo-1-(p-tolyl)pyrrolidine-3-carbonyl]piperidine-4-carboxamide CAS Name: N-(2-ethyl-6-methylphenyl)-1-[[(3S)-1-(4-methylphenyl)-5-oxo-3-pyrrolidinyl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-(2-ethyl-6-methylphenyl)-1-[(3S)-1-(4-methylphenyl)-5-oxopyrrolidine-3-carbonyl]piperidine-4-carboxamide Traditional Name: N-(2-ethyl-6-methyl-phenyl)-1-[(3S)-5-keto-1-(p-tolyl)pyrrolidine-3-carbonyl]isonipecotamide Formula: C27H33N3O3 MolecularWeight: 447.56922

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)C2CCN(CC2)C(=O)C3CC(=O)N(C3)C4=CC=C(C=C4)C)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)C2CCN(CC2)C(=O)[C@H]3CC(=O)N(C3)C4=CC=C(C=C4)C)C

InChI

InChI=1S/C27H33N3O3/c1-4-20-7-5-6-19(3)25(20)28-26(32)21-12-14-29(15-13-21)27(33)22-16-24(31)30(17-22)23-10-8-18(2)9-11-23/h5-11,21-22H,4,12-17H2,1-3H3,(H,28,32)/t22-/m0/s1