[(2R)-1-[(diphenylmethyl)amino]-1-oxidanylidene-propan-2-yl] 3-azanyl-4-chloranyl-benzoate

Systemtic Name: [(2R)-1-[(diphenylmethyl)amino]-1-oxidanylidene-propan-2-yl] 3-azanyl-4-chloranyl-benzoate Openeye Name: [(1R)-2-(benzhydrylamino)-1-methyl-2-oxo-ethyl] 3-amino-4-chloro-benzoate CAS Name: 3-amino-4-chlorobenzoic acid [(2R)-1-[(diphenylmethyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(benzhydrylamino)-1-oxopropan-2-yl] 3-amino-4-chlorobenzoate Traditional Name: 3-amino-4-chloro-benzoic acid [(1R)-2-(benzhydrylamino)-2-keto-1-methyl-ethyl] ester Formula: C23H21ClN2O3 MolecularWeight: 408.87744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(C1=CC=CC=C1)C2=CC=CC=C2)OC(=O)C3=CC(=C(C=C3)Cl)N

Isomeric SMILES

C[C@H](C(=O)NC(C1=CC=CC=C1)C2=CC=CC=C2)OC(=O)C3=CC(=C(C=C3)Cl)N

InChI

InChI=1S/C23H21ClN2O3/c1-15(29-23(28)18-12-13-19(24)20(25)14-18)22(27)26-21(16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-15,21H,25H2,1H3,(H,26,27)/t15-/m1/s1