N-(4-ethoxyphenyl)-4-[2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethanoylamino]benzamide

Systemtic Name: N-(4-ethoxyphenyl)-4-[2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethanoylamino]benzamide Openeye Name: 4-[[2-(4-benzyl-1,4-diazepan-1-yl)acetyl]amino]-N-(4-ethoxyphenyl)benzamide CAS Name: N-(4-ethoxyphenyl)-4-[[1-oxo-2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethyl]amino]benzamide IUPAC Name: 4-[[2-(4-benzyl-1,4-diazepan-1-yl)acetyl]amino]-N-(4-ethoxyphenyl)benzamide Traditional Name: 4-[[2-(4-benzyl-1,4-diazepan-1-yl)acetyl]amino]-N-p-phenetyl-benzamide Formula: C29H34N4O3 MolecularWeight: 486.60526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)NC(=O)CN3CCCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)NC(=O)CN3CCCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C29H34N4O3/c1-2-36-27-15-13-26(14-16-27)31-29(35)24-9-11-25(12-10-24)30-28(34)22-33-18-6-17-32(19-20-33)21-23-7-4-3-5-8-23/h3-5,7-16H,2,6,17-22H2,1H3,(H,30,34)(H,31,35)