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

Systemtic Name: N-[3-(azepan-1-yl)propyl]-1,2-bis(4-methoxyphenyl)-6-oxidanylidene-piperidine-3-carboxamide Openeye Name: N-[3-(azepan-1-yl)propyl]-1,2-bis(4-methoxyphenyl)-6-oxo-piperidine-3-carboxamide CAS Name: N-[3-(1-azepanyl)propyl]-1,2-bis(4-methoxyphenyl)-6-oxo-3-piperidinecarboxamide IUPAC Name: N-[3-(azepan-1-yl)propyl]-1,2-bis(4-methoxyphenyl)-6-oxopiperidine-3-carboxamide Traditional Name: N-[3-(azepan-1-yl)propyl]-6-keto-1,2-bis(4-methoxyphenyl)nipecotamide Formula: C29H39N3O4 MolecularWeight: 493.63766

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C(CCC(=O)N2C3=CC=C(C=C3)OC)C(=O)NCCCN4CCCCCC4

Isomeric SMILES

COC1=CC=C(C=C1)C2C(CCC(=O)N2C3=CC=C(C=C3)OC)C(=O)NCCCN4CCCCCC4

InChI

InChI=1S/C29H39N3O4/c1-35-24-12-8-22(9-13-24)28-26(29(34)30-18-7-21-31-19-5-3-4-6-20-31)16-17-27(33)32(28)23-10-14-25(36-2)15-11-23/h8-15,26,28H,3-7,16-21H2,1-2H3,(H,30,34)