(3R)-3-(cyclohexen-1-yl)-4-oxidanylidene-4-[(phenylmethyl)amino]butanoate

Systemtic Name: (3R)-3-(cyclohexen-1-yl)-4-oxidanylidene-4-[(phenylmethyl)amino]butanoate Openeye Name: (3R)-4-(benzylamino)-3-(cyclohexen-1-yl)-4-oxo-butanoate CAS Name: (3R)-3-(1-cyclohexenyl)-4-oxo-4-[(phenylmethyl)amino]butanoate IUPAC Name: (3R)-4-(benzylamino)-3-(cyclohexen-1-yl)-4-oxobutanoate Traditional Name: (3R)-4-(benzylamino)-3-(cyclohexen-1-yl)-4-keto-butyrate Formula: C17H20NO3- MolecularWeight: 286.3456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)C(CC(=O)[O-])C(=O)NCC2=CC=CC=C2

Isomeric SMILES

C1CCC(=CC1)[C@@H](CC(=O)[O-])C(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C17H21NO3/c19-16(20)11-15(14-9-5-2-6-10-14)17(21)18-12-13-7-3-1-4-8-13/h1,3-4,7-9,15H,2,5-6,10-12H2,(H,18,21)(H,19,20)/p-1/t15-/m1/s1