4-[(3-chloranyl-2-methyl-phenyl)amino]-2-(ethylamino)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(3-chloranyl-2-methyl-phenyl)amino]-2-(ethylamino)-4-oxidanylidene-butanoic acid Openeye Name: 4-(3-chloro-2-methyl-anilino)-2-(ethylamino)-4-oxo-butanoic acid CAS Name: 4-(3-chloro-2-methylanilino)-2-(ethylamino)-4-oxobutanoic acid IUPAC Name: 4-(3-chloro-2-methylanilino)-2-(ethylamino)-4-oxobutanoic acid Traditional Name: 4-(3-chloro-2-methyl-anilino)-2-(ethylamino)-4-keto-butyric acid Formula: C13H17ClN2O3 MolecularWeight: 284.73868

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(CC(=O)NC1=C(C(=CC=C1)Cl)C)C(=O)O

Isomeric SMILES

CCNC(CC(=O)NC1=C(C(=CC=C1)Cl)C)C(=O)O

InChI

InChI=1S/C13H17ClN2O3/c1-3-15-11(13(18)19)7-12(17)16-10-6-4-5-9(14)8(10)2/h4-6,11,15H,3,7H2,1-2H3,(H,16,17)(H,18,19)