1-[(1S)-2-[(2,5-dimethylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]-N-(2-hydroxyphenyl)piperidine-4-carboxamide

Systemtic Name: 1-[(1S)-2-[(2,5-dimethylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]-N-(2-hydroxyphenyl)piperidine-4-carboxamide Openeye Name: 1-[(1S)-2-(2,5-dimethylanilino)-2-oxo-1-phenyl-ethyl]-N-(2-hydroxyphenyl)piperidine-4-carboxamide CAS Name: 1-[(1S)-2-(2,5-dimethylanilino)-2-oxo-1-phenylethyl]-N-(2-hydroxyphenyl)-4-piperidinecarboxamide IUPAC Name: 1-[(1S)-2-(2,5-dimethylanilino)-2-oxo-1-phenylethyl]-N-(2-hydroxyphenyl)piperidine-4-carboxamide Traditional Name: 1-[(1S)-2-(2,5-dimethylanilino)-2-keto-1-phenyl-ethyl]-N-(2-hydroxyphenyl)isonipecotamide Formula: C28H31N3O3 MolecularWeight: 457.56404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C(C2=CC=CC=C2)N3CCC(CC3)C(=O)NC4=CC=CC=C4O

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)[C@H](C2=CC=CC=C2)N3CCC(CC3)C(=O)NC4=CC=CC=C4O

InChI

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