(phenylmethyl) N-(2-azanyl-8-oxidanylidene-4,5,6,7-tetrahydro-1H-1,3-diazocin-7-yl)carbamate

Systemtic Name: (phenylmethyl) N-(2-azanyl-8-oxidanylidene-4,5,6,7-tetrahydro-1H-1,3-diazocin-7-yl)carbamate Openeye Name: benzyl N-(2-amino-8-oxo-4,5,6,7-tetrahydro-1H-1,3-diazocin-7-yl)carbamate CAS Name: N-(2-amino-8-oxo-4,5,6,7-tetrahydro-1H-1,3-diazocin-7-yl)carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-(2-amino-8-oxo-4,5,6,7-tetrahydro-1H-1,3-diazocin-7-yl)carbamate Traditional Name: N-(2-amino-8-keto-4,5,6,7-tetrahydro-1H-1,3-diazocin-7-yl)carbamic acid benzyl ester Formula: C14H18N4O3 MolecularWeight: 290.31772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(=O)NC(=NC1)N)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1CC(C(=O)NC(=NC1)N)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C14H18N4O3/c15-13-16-8-4-7-11(12(19)18-13)17-14(20)21-9-10-5-2-1-3-6-10/h1-3,5-6,11H,4,7-9H2,(H,17,20)(H3,15,16,18,19)