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

Systemtic Name: (2R)-2-(dimethylazaniumyl)-4-[(3-ethanoylphenyl)amino]-4-oxidanylidene-butanoate Openeye Name: (2R)-4-(3-acetylanilino)-2-(dimethylammonio)-4-oxo-butanoate CAS Name: (2R)-4-(3-acetylanilino)-2-(dimethylammonio)-4-oxobutanoate IUPAC Name: (2R)-4-(3-acetylanilino)-2-(dimethylazaniumyl)-4-oxobutanoate Traditional Name: (2R)-4-(3-acetylanilino)-2-(dimethylammonio)-4-keto-butyrate Formula: C14H18N2O4 MolecularWeight: 278.30372

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18N2O4/c1-9(17)10-5-4-6-11(7-10)15-13(18)8-12(14(19)20)16(2)3/h4-7,12H,8H2,1-3H3,(H,15,18)(H,19,20)/t12-/m1/s1