N-[3-(azepan-1-yl)propyl]-2-(3,4-dimethoxyphenyl)-1-(4-methoxyphenyl)-6-oxidanylidene-piperidine-3-carboxamide

Systemtic Name: N-[3-(azepan-1-yl)propyl]-2-(3,4-dimethoxyphenyl)-1-(4-methoxyphenyl)-6-oxidanylidene-piperidine-3-carboxamide Openeye Name: N-[3-(azepan-1-yl)propyl]-2-(3,4-dimethoxyphenyl)-1-(4-methoxyphenyl)-6-oxo-piperidine-3-carboxamide CAS Name: N-[3-(1-azepanyl)propyl]-2-(3,4-dimethoxyphenyl)-1-(4-methoxyphenyl)-6-oxo-3-piperidinecarboxamide IUPAC Name: N-[3-(azepan-1-yl)propyl]-2-(3,4-dimethoxyphenyl)-1-(4-methoxyphenyl)-6-oxopiperidine-3-carboxamide Traditional Name: N-[3-(azepan-1-yl)propyl]-2-(3,4-dimethoxyphenyl)-6-keto-1-(4-methoxyphenyl)nipecotamide Formula: C30H41N3O5 MolecularWeight: 523.66364

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(C(CCC2=O)C(=O)NCCCN3CCCCCC3)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)N2C(C(CCC2=O)C(=O)NCCCN3CCCCCC3)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C30H41N3O5/c1-36-24-12-10-23(11-13-24)33-28(34)16-14-25(29(33)22-9-15-26(37-2)27(21-22)38-3)30(35)31-17-8-20-32-18-6-4-5-7-19-32/h9-13,15,21,25,29H,4-8,14,16-20H2,1-3H3,(H,31,35)