2-[7-oxidanylidene-4-(phenylmethyl)-1,4-diazepan-1-yl]ethyl N-(4-ethanoylphenyl)carbamate

Systemtic Name: 2-[7-oxidanylidene-4-(phenylmethyl)-1,4-diazepan-1-yl]ethyl N-(4-ethanoylphenyl)carbamate Openeye Name: 2-(4-benzyl-7-oxo-1,4-diazepan-1-yl)ethyl N-(4-acetylphenyl)carbamate CAS Name: N-(4-acetylphenyl)carbamic acid 2-[7-oxo-4-(phenylmethyl)-1,4-diazepan-1-yl]ethyl ester IUPAC Name: 2-(4-benzyl-7-oxo-1,4-diazepan-1-yl)ethyl N-(4-acetylphenyl)carbamate Traditional Name: N-(4-acetylphenyl)carbamic acid 2-(4-benzyl-7-keto-1,4-diazepan-1-yl)ethyl ester Formula: C23H27N3O4 MolecularWeight: 409.47818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)NC(=O)OCCN2CCN(CCC2=O)CC3=CC=CC=C3

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)NC(=O)OCCN2CCN(CCC2=O)CC3=CC=CC=C3

InChI

InChI=1S/C23H27N3O4/c1-18(27)20-7-9-21(10-8-20)24-23(29)30-16-15-26-14-13-25(12-11-22(26)28)17-19-5-3-2-4-6-19/h2-10H,11-17H2,1H3,(H,24,29)