[(1R)-1-(2-chlorophenyl)ethyl] 4-(2-cyanoethanoylamino)benzoate

Systemtic Name: [(1R)-1-(2-chlorophenyl)ethyl] 4-(2-cyanoethanoylamino)benzoate Openeye Name: [(1R)-1-(2-chlorophenyl)ethyl] 4-[(2-cyanoacetyl)amino]benzoate CAS Name: 4-[(2-cyano-1-oxoethyl)amino]benzoic acid [(1R)-1-(2-chlorophenyl)ethyl] ester IUPAC Name: [(1R)-1-(2-chlorophenyl)ethyl] 4-[(2-cyanoacetyl)amino]benzoate Traditional Name: 4-[(2-cyanoacetyl)amino]benzoic acid [(1R)-1-(2-chlorophenyl)ethyl] ester Formula: C18H15ClN2O3 MolecularWeight: 342.7763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1Cl)OC(=O)C2=CC=C(C=C2)NC(=O)CC#N

Isomeric SMILES

C[C@H](C1=CC=CC=C1Cl)OC(=O)C2=CC=C(C=C2)NC(=O)CC#N

InChI

InChI=1S/C18H15ClN2O3/c1-12(15-4-2-3-5-16(15)19)24-18(23)13-6-8-14(9-7-13)21-17(22)10-11-20/h2-9,12H,10H2,1H3,(H,21,22)/t12-/m1/s1