(2R)-4-[(3,4-dichlorophenyl)amino]-4-oxidanylidene-2-(prop-2-enylazaniumyl)butanoate

Systemtic Name: (2R)-4-[(3,4-dichlorophenyl)amino]-4-oxidanylidene-2-(prop-2-enylazaniumyl)butanoate Openeye Name: (2R)-2-(allylammonio)-4-(3,4-dichloroanilino)-4-oxo-butanoate CAS Name: (2R)-4-(3,4-dichloroanilino)-4-oxo-2-(prop-2-enylammonio)butanoate IUPAC Name: (2R)-4-(3,4-dichloroanilino)-4-oxo-2-(prop-2-enylazaniumyl)butanoate Traditional Name: (2R)-2-(allylammonio)-4-(3,4-dichloroanilino)-4-keto-butyrate Formula: C13H14Cl2N2O3 MolecularWeight: 317.16786

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Descriptors Computed from Structure

Canonical SMILES:

C=CC[NH2+]C(CC(=O)NC1=CC(=C(C=C1)Cl)Cl)C(=O)[O-]

Isomeric SMILES

C=CC[NH2+][C@H](CC(=O)NC1=CC(=C(C=C1)Cl)Cl)C(=O)[O-]

InChI

InChI=1S/C13H14Cl2N2O3/c1-2-5-16-11(13(19)20)7-12(18)17-8-3-4-9(14)10(15)6-8/h2-4,6,11,16H,1,5,7H2,(H,17,18)(H,19,20)/t11-/m1/s1