4-(azepan-1-ylmethyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide

Systemtic Name: 4-(azepan-1-ylmethyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide Openeye Name: 4-(azepan-1-ylmethyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide CAS Name: 4-(1-azepanylmethyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide IUPAC Name: 4-(azepan-1-ylmethyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide Traditional Name: 4-(azepan-1-ylmethyl)-N-homoveratryl-benzamide Formula: C24H32N2O3 MolecularWeight: 396.52248

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2=CC=C(C=C2)CN3CCCCCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C2=CC=C(C=C2)CN3CCCCCC3)OC

InChI

InChI=1S/C24H32N2O3/c1-28-22-12-9-19(17-23(22)29-2)13-14-25-24(27)21-10-7-20(8-11-21)18-26-15-5-3-4-6-16-26/h7-12,17H,3-6,13-16,18H2,1-2H3,(H,25,27)