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

Systemtic Name: 1-phenethyl-4-[(4-phenylmethoxyphenyl)methyl]-1,4-diazepane Openeye Name: 1-[(4-benzyloxyphenyl)methyl]-4-phenethyl-1,4-diazepane CAS Name: 1-phenethyl-4-[(4-phenylmethoxyphenyl)methyl]-1,4-diazepane IUPAC Name: 1-phenethyl-4-[(4-phenylmethoxyphenyl)methyl]-1,4-diazepane Traditional Name: 1-(4-benzoxybenzyl)-4-phenethyl-1,4-diazepane Formula: C27H32N2O MolecularWeight: 400.55578

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)CC2=CC=C(C=C2)OCC3=CC=CC=C3)CCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN(C1)CC2=CC=C(C=C2)OCC3=CC=CC=C3)CCC4=CC=CC=C4

InChI

InChI=1S/C27H32N2O/c1-3-8-24(9-4-1)16-19-28-17-7-18-29(21-20-28)22-25-12-14-27(15-13-25)30-23-26-10-5-2-6-11-26/h1-6,8-15H,7,16-23H2