3-[(4-phenylmethoxyphenyl)methylamino]azepan-2-one

Systemtic Name: 3-[(4-phenylmethoxyphenyl)methylamino]azepan-2-one Openeye Name: 3-[(4-benzyloxyphenyl)methylamino]azepan-2-one CAS Name: 3-[(4-phenylmethoxyphenyl)methylamino]-2-azepanone IUPAC Name: 3-[(4-phenylmethoxyphenyl)methylamino]azepan-2-one Traditional Name: 3-[(4-benzoxybenzyl)amino]azepan-2-one Formula: C20H24N2O2 MolecularWeight: 324.41676

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NCC2=CC=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

C1CCNC(=O)C(C1)NCC2=CC=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C20H24N2O2/c23-20-19(8-4-5-13-21-20)22-14-16-9-11-18(12-10-16)24-15-17-6-2-1-3-7-17/h1-3,6-7,9-12,19,22H,4-5,8,13-15H2,(H,21,23)