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

Systemtic Name: 4-[(5-chloranyl-2-methyl-phenyl)amino]-4-oxidanylidene-2-(propylamino)butanoic acid Openeye Name: 4-(5-chloro-2-methyl-anilino)-4-oxo-2-(propylamino)butanoic acid CAS Name: 4-(5-chloro-2-methylanilino)-4-oxo-2-(propylamino)butanoic acid IUPAC Name: 4-(5-chloro-2-methylanilino)-4-oxo-2-(propylamino)butanoic acid Traditional Name: 4-(5-chloro-2-methyl-anilino)-4-keto-2-(propylamino)butyric acid Formula: C14H19ClN2O3 MolecularWeight: 298.76526

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19ClN2O3/c1-3-6-16-12(14(19)20)8-13(18)17-11-7-10(15)5-4-9(11)2/h4-5,7,12,16H,3,6,8H2,1-2H3,(H,17,18)(H,19,20)