4-[(2R)-2-(4-methoxyphenyl)azepan-1-yl]carbonyl-N-phenyl-piperidine-1-carboxamide

Systemtic Name: 4-[(2R)-2-(4-methoxyphenyl)azepan-1-yl]carbonyl-N-phenyl-piperidine-1-carboxamide Openeye Name: 4-[(2R)-2-(4-methoxyphenyl)azepane-1-carbonyl]-N-phenyl-piperidine-1-carboxamide CAS Name: 4-[[(2R)-2-(4-methoxyphenyl)-1-azepanyl]-oxomethyl]-N-phenyl-1-piperidinecarboxamide IUPAC Name: 4-[(2R)-2-(4-methoxyphenyl)azepane-1-carbonyl]-N-phenylpiperidine-1-carboxamide Traditional Name: 4-[(2R)-2-(4-methoxyphenyl)azepane-1-carbonyl]-N-phenyl-piperidine-1-carboxamide Formula: C26H33N3O3 MolecularWeight: 435.55852

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCCCCN2C(=O)C3CCN(CC3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)[C@H]2CCCCCN2C(=O)C3CCN(CC3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C26H33N3O3/c1-32-23-13-11-20(12-14-23)24-10-6-3-7-17-29(24)25(30)21-15-18-28(19-16-21)26(31)27-22-8-4-2-5-9-22/h2,4-5,8-9,11-14,21,24H,3,6-7,10,15-19H2,1H3,(H,27,31)/t24-/m1/s1