(2R)-2-azaniumyl-4-[(5-chloranyl-2-methoxy-phenyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: (2R)-2-azaniumyl-4-[(5-chloranyl-2-methoxy-phenyl)amino]-4-oxidanylidene-butanoate Openeye Name: (2R)-2-azaniumyl-4-(5-chloro-2-methoxy-anilino)-4-oxo-butanoate CAS Name: (2R)-2-ammonio-4-(5-chloro-2-methoxyanilino)-4-oxobutanoate IUPAC Name: (2R)-2-azaniumyl-4-(5-chloro-2-methoxyanilino)-4-oxobutanoate Traditional Name: (2R)-2-ammonio-4-(5-chloro-2-methoxy-anilino)-4-keto-butyrate Formula: C11H13ClN2O4 MolecularWeight: 272.68492

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=O)CC(C(=O)[O-])[NH3+]

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=O)C[C@H](C(=O)[O-])[NH3+]

InChI

InChI=1S/C11H13ClN2O4/c1-18-9-3-2-6(12)4-8(9)14-10(15)5-7(13)11(16)17/h2-4,7H,5,13H2,1H3,(H,14,15)(H,16,17)/t7-/m1/s1