4-[(5-chloranyl-2-methyl-phenyl)amino]-2-(2-hydroxyethylamino)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(5-chloranyl-2-methyl-phenyl)amino]-2-(2-hydroxyethylamino)-4-oxidanylidene-butanoic acid Openeye Name: 4-(5-chloro-2-methyl-anilino)-2-(2-hydroxyethylamino)-4-oxo-butanoic acid CAS Name: 4-(5-chloro-2-methylanilino)-2-(2-hydroxyethylamino)-4-oxobutanoic acid IUPAC Name: 4-(5-chloro-2-methylanilino)-2-(2-hydroxyethylamino)-4-oxobutanoic acid Traditional Name: 4-(5-chloro-2-methyl-anilino)-2-(2-hydroxyethylamino)-4-keto-butyric acid Formula: C13H17ClN2O4 MolecularWeight: 300.73808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)NC(=O)CC(C(=O)O)NCCO

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)NC(=O)CC(C(=O)O)NCCO

InChI

InChI=1S/C13H17ClN2O4/c1-8-2-3-9(14)6-10(8)16-12(18)7-11(13(19)20)15-4-5-17/h2-3,6,11,15,17H,4-5,7H2,1H3,(H,16,18)(H,19,20)