[2-[[(1S)-1-(2-methylphenyl)ethyl]amino]-2-oxidanylidene-ethyl] 2-azanyl-4-chloranyl-benzoate

Systemtic Name: [2-[[(1S)-1-(2-methylphenyl)ethyl]amino]-2-oxidanylidene-ethyl] 2-azanyl-4-chloranyl-benzoate Openeye Name: [2-[[(1S)-1-(o-tolyl)ethyl]amino]-2-oxo-ethyl] 2-amino-4-chloro-benzoate CAS Name: 2-amino-4-chlorobenzoic acid [2-[[(1S)-1-(2-methylphenyl)ethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(1S)-1-(2-methylphenyl)ethyl]amino]-2-oxoethyl] 2-amino-4-chlorobenzoate Traditional Name: 2-amino-4-chloro-benzoic acid [2-keto-2-[[(1S)-1-(o-tolyl)ethyl]amino]ethyl] ester Formula: C18H19ClN2O3 MolecularWeight: 346.80806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C)NC(=O)COC(=O)C2=C(C=C(C=C2)Cl)N

Isomeric SMILES

CC1=CC=CC=C1[C@H](C)NC(=O)COC(=O)C2=C(C=C(C=C2)Cl)N

InChI

InChI=1S/C18H19ClN2O3/c1-11-5-3-4-6-14(11)12(2)21-17(22)10-24-18(23)15-8-7-13(19)9-16(15)20/h3-9,12H,10,20H2,1-2H3,(H,21,22)/t12-/m0/s1