(phenylmethyl) N-[(3S)-2-oxidanylidene-1-phenylmethoxy-azepan-3-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(3S)-2-oxidanylidene-1-phenylmethoxy-azepan-3-yl]carbamate Openeye Name: benzyl N-[(3S)-1-benzyloxy-2-oxo-azepan-3-yl]carbamate CAS Name: N-[(3S)-2-oxo-1-phenylmethoxy-3-azepanyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(3S)-2-oxo-1-phenylmethoxyazepan-3-yl]carbamate Traditional Name: N-[(3S)-1-benzoxy-2-keto-azepan-3-yl]carbamic acid benzyl ester Formula: C21H24N2O4 MolecularWeight: 368.42626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(=O)C(C1)NC(=O)OCC2=CC=CC=C2)OCC3=CC=CC=C3

Isomeric SMILES

C1CCN(C(=O)[C@H](C1)NC(=O)OCC2=CC=CC=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C21H24N2O4/c24-20-19(22-21(25)26-15-17-9-3-1-4-10-17)13-7-8-14-23(20)27-16-18-11-5-2-6-12-18/h1-6,9-12,19H,7-8,13-16H2,(H,22,25)/t19-/m0/s1