[(2R)-1-(cyclohexylmethylamino)-1-oxidanylidene-propan-2-yl] 2-azanyl-4-chloranyl-benzoate

Systemtic Name: [(2R)-1-(cyclohexylmethylamino)-1-oxidanylidene-propan-2-yl] 2-azanyl-4-chloranyl-benzoate Openeye Name: [(1R)-2-(cyclohexylmethylamino)-1-methyl-2-oxo-ethyl] 2-amino-4-chloro-benzoate CAS Name: 2-amino-4-chlorobenzoic acid [(2R)-1-(cyclohexylmethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(cyclohexylmethylamino)-1-oxopropan-2-yl] 2-amino-4-chlorobenzoate Traditional Name: 2-amino-4-chloro-benzoic acid [(1R)-2-(cyclohexylmethylamino)-2-keto-1-methyl-ethyl] ester Formula: C17H23ClN2O3 MolecularWeight: 338.82912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1CCCCC1)OC(=O)C2=C(C=C(C=C2)Cl)N

Isomeric SMILES

C[C@H](C(=O)NCC1CCCCC1)OC(=O)C2=C(C=C(C=C2)Cl)N

InChI

InChI=1S/C17H23ClN2O3/c1-11(16(21)20-10-12-5-3-2-4-6-12)23-17(22)14-8-7-13(18)9-15(14)19/h7-9,11-12H,2-6,10,19H2,1H3,(H,20,21)/t11-/m1/s1