4-(azepan-1-ylmethyl)-N-[(2,3,4-trimethoxyphenyl)methyl]benzamide

Systemtic Name: 4-(azepan-1-ylmethyl)-N-[(2,3,4-trimethoxyphenyl)methyl]benzamide Openeye Name: 4-(azepan-1-ylmethyl)-N-[(2,3,4-trimethoxyphenyl)methyl]benzamide CAS Name: 4-(1-azepanylmethyl)-N-[(2,3,4-trimethoxyphenyl)methyl]benzamide IUPAC Name: 4-(azepan-1-ylmethyl)-N-[(2,3,4-trimethoxyphenyl)methyl]benzamide Traditional Name: 4-(azepan-1-ylmethyl)-N-(2,3,4-trimethoxybenzyl)benzamide Formula: C24H32N2O4 MolecularWeight: 412.52188

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H32N2O4/c1-28-21-13-12-20(22(29-2)23(21)30-3)16-25-24(27)19-10-8-18(9-11-19)17-26-14-6-4-5-7-15-26/h8-13H,4-7,14-17H2,1-3H3,(H,25,27)