N-(4-ethoxyphenyl)-4-(phenylmethyl)-1,4-diazepane-1-carboxamide

Systemtic Name: N-(4-ethoxyphenyl)-4-(phenylmethyl)-1,4-diazepane-1-carboxamide Openeye Name: 4-benzyl-N-(4-ethoxyphenyl)-1,4-diazepane-1-carboxamide CAS Name: N-(4-ethoxyphenyl)-4-(phenylmethyl)-1,4-diazepane-1-carboxamide IUPAC Name: 4-benzyl-N-(4-ethoxyphenyl)-1,4-diazepane-1-carboxamide Traditional Name: 4-benzyl-N-p-phenetyl-1,4-diazepane-1-carboxamide Formula: C21H27N3O2 MolecularWeight: 353.45798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)N2CCCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)N2CCCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C21H27N3O2/c1-2-26-20-11-9-19(10-12-20)22-21(25)24-14-6-13-23(15-16-24)17-18-7-4-3-5-8-18/h3-5,7-12H,2,6,13-17H2,1H3,(H,22,25)