3-azanyl-4-[carboxymethyl(phenyl)amino]-4-oxidanylidene-butanoic acid hydrochloride

Systemtic Name: 3-azanyl-4-[carboxymethyl(phenyl)amino]-4-oxidanylidene-butanoic acid hydrochloride Openeye Name: 3-amino-4-[N-(carboxymethyl)anilino]-4-oxo-butanoic acid hydrochloride CAS Name: 3-amino-4-[N-(carboxymethyl)anilino]-4-oxobutanoic acid hydrochloride IUPAC Name: 3-amino-4-[N-(carboxymethyl)anilino]-4-oxobutanoic acid hydrochloride Traditional Name: 3-amino-4-[N-(carboxymethyl)anilino]-4-keto-butyric acid hydrochloride Formula: C12H15ClN2O5 MolecularWeight: 302.7109

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(CC(=O)O)C(=O)C(CC(=O)O)N.Cl

Isomeric SMILES

C1=CC=C(C=C1)N(CC(=O)O)C(=O)C(CC(=O)O)N.Cl

InChI

InChI=1S/C12H14N2O5.ClH/c13-9(6-10(15)16)12(19)14(7-11(17)18)8-4-2-1-3-5-8;/h1-5,9H,6-7,13H2,(H,15,16)(H,17,18);1H