2-[4-[(4-cyanophenyl)methyl]-1,4-diazepan-1-yl]-N-(4-phenylmethoxyphenyl)ethanamide

Systemtic Name: 2-[4-[(4-cyanophenyl)methyl]-1,4-diazepan-1-yl]-N-(4-phenylmethoxyphenyl)ethanamide Openeye Name: N-(4-benzyloxyphenyl)-2-[4-[(4-cyanophenyl)methyl]-1,4-diazepan-1-yl]acetamide CAS Name: 2-[4-[(4-cyanophenyl)methyl]-1,4-diazepan-1-yl]-N-(4-phenylmethoxyphenyl)acetamide IUPAC Name: 2-[4-[(4-cyanophenyl)methyl]-1,4-diazepan-1-yl]-N-(4-phenylmethoxyphenyl)acetamide Traditional Name: N-(4-benzoxyphenyl)-2-[4-(4-cyanobenzyl)-1,4-diazepan-1-yl]acetamide Formula: C28H30N4O2 MolecularWeight: 454.5634

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)CC(=O)NC2=CC=C(C=C2)OCC3=CC=CC=C3)CC4=CC=C(C=C4)C#N

Isomeric SMILES

C1CN(CCN(C1)CC(=O)NC2=CC=C(C=C2)OCC3=CC=CC=C3)CC4=CC=C(C=C4)C#N

InChI

InChI=1S/C28H30N4O2/c29-19-23-7-9-24(10-8-23)20-31-15-4-16-32(18-17-31)21-28(33)30-26-11-13-27(14-12-26)34-22-25-5-2-1-3-6-25/h1-3,5-14H,4,15-18,20-22H2,(H,30,33)