[(2R)-1-[(2-chlorophenyl)methylamino]-1-oxidanylidene-propan-2-yl] 3-azanyl-4-methyl-benzoate

Systemtic Name: [(2R)-1-[(2-chlorophenyl)methylamino]-1-oxidanylidene-propan-2-yl] 3-azanyl-4-methyl-benzoate Openeye Name: [(1R)-2-[(2-chlorophenyl)methylamino]-1-methyl-2-oxo-ethyl] 3-amino-4-methyl-benzoate CAS Name: 3-amino-4-methylbenzoic acid [(2R)-1-[(2-chlorophenyl)methylamino]-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-[(2-chlorophenyl)methylamino]-1-oxopropan-2-yl] 3-amino-4-methylbenzoate Traditional Name: 3-amino-4-methyl-benzoic acid [(1R)-2-[(2-chlorobenzyl)amino]-2-keto-1-methyl-ethyl] ester Formula: C18H19ClN2O3 MolecularWeight: 346.80806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC(C)C(=O)NCC2=CC=CC=C2Cl)N

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O[C@H](C)C(=O)NCC2=CC=CC=C2Cl)N

InChI

InChI=1S/C18H19ClN2O3/c1-11-7-8-13(9-16(11)20)18(23)24-12(2)17(22)21-10-14-5-3-4-6-15(14)19/h3-9,12H,10,20H2,1-2H3,(H,21,22)/t12-/m1/s1