(2R)-4-[(3-chlorophenyl)amino]-2-(dimethylazaniumyl)-4-oxidanylidene-butanoate

Systemtic Name: (2R)-4-[(3-chlorophenyl)amino]-2-(dimethylazaniumyl)-4-oxidanylidene-butanoate Openeye Name: (2R)-4-(3-chloroanilino)-2-(dimethylammonio)-4-oxo-butanoate CAS Name: (2R)-4-(3-chloroanilino)-2-(dimethylammonio)-4-oxobutanoate IUPAC Name: (2R)-4-(3-chloroanilino)-2-(dimethylazaniumyl)-4-oxobutanoate Traditional Name: (2R)-4-(3-chloroanilino)-2-(dimethylammonio)-4-keto-butyrate Formula: C12H15ClN2O3 MolecularWeight: 270.7121

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CC(=O)NC1=CC(=CC=C1)Cl)C(=O)[O-]

Isomeric SMILES

C[NH+](C)[C@H](CC(=O)NC1=CC(=CC=C1)Cl)C(=O)[O-]

InChI

InChI=1S/C12H15ClN2O3/c1-15(2)10(12(17)18)7-11(16)14-9-5-3-4-8(13)6-9/h3-6,10H,7H2,1-2H3,(H,14,16)(H,17,18)/t10-/m1/s1