1-[(1S)-2-[(2-methoxy-5-methyl-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]-N-phenyl-piperidine-4-carboxamide

Systemtic Name: 1-[(1S)-2-[(2-methoxy-5-methyl-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]-N-phenyl-piperidine-4-carboxamide Openeye Name: 1-[(1S)-2-(2-methoxy-5-methyl-anilino)-2-oxo-1-phenyl-ethyl]-N-phenyl-piperidine-4-carboxamide CAS Name: 1-[(1S)-2-(2-methoxy-5-methylanilino)-2-oxo-1-phenylethyl]-N-phenyl-4-piperidinecarboxamide IUPAC Name: 1-[(1S)-2-(2-methoxy-5-methylanilino)-2-oxo-1-phenylethyl]-N-phenylpiperidine-4-carboxamide Traditional Name: 1-[(1S)-2-keto-2-(2-methoxy-5-methyl-anilino)-1-phenyl-ethyl]-N-phenyl-isonipecotamide Formula: C28H31N3O3 MolecularWeight: 457.56404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)C(C2=CC=CC=C2)N3CCC(CC3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)[C@H](C2=CC=CC=C2)N3CCC(CC3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C28H31N3O3/c1-20-13-14-25(34-2)24(19-20)30-28(33)26(21-9-5-3-6-10-21)31-17-15-22(16-18-31)27(32)29-23-11-7-4-8-12-23/h3-14,19,22,26H,15-18H2,1-2H3,(H,29,32)(H,30,33)/t26-/m0/s1