N-phenethyl-2-[4-[2-(4-phenylmethoxyphenyl)ethanoyl]-1,4-diazepan-1-yl]ethanamide

Systemtic Name: N-phenethyl-2-[4-[2-(4-phenylmethoxyphenyl)ethanoyl]-1,4-diazepan-1-yl]ethanamide Openeye Name: 2-[4-[2-(4-benzyloxyphenyl)acetyl]-1,4-diazepan-1-yl]-N-phenethyl-acetamide CAS Name: 2-[4-[1-oxo-2-(4-phenylmethoxyphenyl)ethyl]-1,4-diazepan-1-yl]-N-phenethylacetamide IUPAC Name: N-phenethyl-2-[4-[2-(4-phenylmethoxyphenyl)acetyl]-1,4-diazepan-1-yl]acetamide Traditional Name: 2-[4-[2-(4-benzoxyphenyl)acetyl]-1,4-diazepan-1-yl]-N-phenethyl-acetamide Formula: C30H35N3O3 MolecularWeight: 485.6172

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)CC2=CC=C(C=C2)OCC3=CC=CC=C3)CC(=O)NCCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN(C1)C(=O)CC2=CC=C(C=C2)OCC3=CC=CC=C3)CC(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C30H35N3O3/c34-29(31-17-16-25-8-3-1-4-9-25)23-32-18-7-19-33(21-20-32)30(35)22-26-12-14-28(15-13-26)36-24-27-10-5-2-6-11-27/h1-6,8-15H,7,16-24H2,(H,31,34)