N-[[4-[[4-(phenylmethyl)-1,4-diazepan-1-yl]carbonyl]phenyl]methyl]ethanamide

Systemtic Name: N-[[4-[[4-(phenylmethyl)-1,4-diazepan-1-yl]carbonyl]phenyl]methyl]ethanamide Openeye Name: N-[[4-(4-benzyl-1,4-diazepane-1-carbonyl)phenyl]methyl]acetamide CAS Name: N-[[4-[oxo-[4-(phenylmethyl)-1,4-diazepan-1-yl]methyl]phenyl]methyl]acetamide IUPAC Name: N-[[4-(4-benzyl-1,4-diazepane-1-carbonyl)phenyl]methyl]acetamide Traditional Name: N-[4-(4-benzyl-1,4-diazepane-1-carbonyl)benzyl]acetamide Formula: C22H27N3O2 MolecularWeight: 365.46868

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1=CC=C(C=C1)C(=O)N2CCCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC(=O)NCC1=CC=C(C=C1)C(=O)N2CCCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C22H27N3O2/c1-18(26)23-16-19-8-10-21(11-9-19)22(27)25-13-5-12-24(14-15-25)17-20-6-3-2-4-7-20/h2-4,6-11H,5,12-17H2,1H3,(H,23,26)