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

Systemtic Name: N-(4-methoxyphenyl)-2-[2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethanoylamino]benzamide Openeye Name: 2-[[2-(4-benzyl-1,4-diazepan-1-yl)acetyl]amino]-N-(4-methoxyphenyl)benzamide CAS Name: N-(4-methoxyphenyl)-2-[[1-oxo-2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethyl]amino]benzamide IUPAC Name: 2-[[2-(4-benzyl-1,4-diazepan-1-yl)acetyl]amino]-N-(4-methoxyphenyl)benzamide Traditional Name: 2-[[2-(4-benzyl-1,4-diazepan-1-yl)acetyl]amino]-N-(4-methoxyphenyl)benzamide Formula: C28H32N4O3 MolecularWeight: 472.57868

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2NC(=O)CN3CCCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2NC(=O)CN3CCCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C28H32N4O3/c1-35-24-14-12-23(13-15-24)29-28(34)25-10-5-6-11-26(25)30-27(33)21-32-17-7-16-31(18-19-32)20-22-8-3-2-4-9-22/h2-6,8-15H,7,16-21H2,1H3,(H,29,34)(H,30,33)