(phenylmethyl) (3S)-3-azanyl-4-(azocan-1-yl)-4-oxidanylidene-butanoate

Systemtic Name: (phenylmethyl) (3S)-3-azanyl-4-(azocan-1-yl)-4-oxidanylidene-butanoate Openeye Name: benzyl (3S)-3-amino-4-(azocan-1-yl)-4-oxo-butanoate CAS Name: (3S)-3-amino-4-(1-azocanyl)-4-oxobutanoic acid (phenylmethyl) ester IUPAC Name: benzyl (3S)-3-amino-4-(azocan-1-yl)-4-oxobutanoate Traditional Name: (3S)-3-amino-4-(azocan-1-yl)-4-keto-butyric acid benzyl ester Formula: C18H26N2O3 MolecularWeight: 318.41064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)C(=O)C(CC(=O)OCC2=CC=CC=C2)N

Isomeric SMILES

C1CCCN(CCC1)C(=O)[C@H](CC(=O)OCC2=CC=CC=C2)N

InChI

InChI=1S/C18H26N2O3/c19-16(18(22)20-11-7-2-1-3-8-12-20)13-17(21)23-14-15-9-5-4-6-10-15/h4-6,9-10,16H,1-3,7-8,11-14,19H2/t16-/m0/s1