1-butyl-4-[(4-phenylmethoxyphenyl)methyl]-1,4-diazepane

Systemtic Name: 1-butyl-4-[(4-phenylmethoxyphenyl)methyl]-1,4-diazepane Openeye Name: 1-[(4-benzyloxyphenyl)methyl]-4-butyl-1,4-diazepane CAS Name: 1-butyl-4-[(4-phenylmethoxyphenyl)methyl]-1,4-diazepane IUPAC Name: 1-butyl-4-[(4-phenylmethoxyphenyl)methyl]-1,4-diazepane Traditional Name: 1-(4-benzoxybenzyl)-4-butyl-1,4-diazepane Formula: C23H32N2O MolecularWeight: 352.51298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCCN(CC1)CC2=CC=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

CCCCN1CCCN(CC1)CC2=CC=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C23H32N2O/c1-2-3-14-24-15-7-16-25(18-17-24)19-21-10-12-23(13-11-21)26-20-22-8-5-4-6-9-22/h4-6,8-13H,2-3,7,14-20H2,1H3