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

Systemtic Name: 1-[2-[(2R)-2-(4-methoxyphenyl)azepan-1-yl]ethanoyl]-N-phenyl-piperidine-4-carboxamide Openeye Name: 1-[2-[(2R)-2-(4-methoxyphenyl)azepan-1-yl]acetyl]-N-phenyl-piperidine-4-carboxamide CAS Name: 1-[2-[(2R)-2-(4-methoxyphenyl)-1-azepanyl]-1-oxoethyl]-N-phenyl-4-piperidinecarboxamide IUPAC Name: 1-[2-[(2R)-2-(4-methoxyphenyl)azepan-1-yl]acetyl]-N-phenylpiperidine-4-carboxamide Traditional Name: 1-[2-[(2R)-2-(4-methoxyphenyl)azepan-1-yl]acetyl]-N-phenyl-isonipecotamide Formula: C27H35N3O3 MolecularWeight: 449.5851

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCCCCN2CC(=O)N3CCC(CC3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)[C@H]2CCCCCN2CC(=O)N3CCC(CC3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C27H35N3O3/c1-33-24-13-11-21(12-14-24)25-10-6-3-7-17-30(25)20-26(31)29-18-15-22(16-19-29)27(32)28-23-8-4-2-5-9-23/h2,4-5,8-9,11-14,22,25H,3,6-7,10,15-20H2,1H3,(H,28,32)/t25-/m1/s1