[(2S)-1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl] 2-azanyl-3,5-bis(chloranyl)benzoate

Systemtic Name: [(2S)-1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl] 2-azanyl-3,5-bis(chloranyl)benzoate Openeye Name: [(1S)-1-methyl-2-oxo-2-(p-tolyl)ethyl] 2-amino-3,5-dichloro-benzoate CAS Name: 2-amino-3,5-dichlorobenzoic acid [(2S)-1-(4-methylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(4-methylphenyl)-1-oxopropan-2-yl] 2-amino-3,5-dichlorobenzoate Traditional Name: 2-amino-3,5-dichloro-benzoic acid [(1S)-2-keto-1-methyl-2-(p-tolyl)ethyl] ester Formula: C17H15Cl2NO3 MolecularWeight: 352.2119

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C(C)OC(=O)C2=CC(=CC(=C2N)Cl)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)[C@H](C)OC(=O)C2=CC(=CC(=C2N)Cl)Cl

InChI

InChI=1S/C17H15Cl2NO3/c1-9-3-5-11(6-4-9)16(21)10(2)23-17(22)13-7-12(18)8-14(19)15(13)20/h3-8,10H,20H2,1-2H3/t10-/m0/s1