4-[(5-chloranyl-2-methyl-phenyl)amino]-2-(3-methoxypropylamino)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(5-chloranyl-2-methyl-phenyl)amino]-2-(3-methoxypropylamino)-4-oxidanylidene-butanoic acid Openeye Name: 4-(5-chloro-2-methyl-anilino)-2-(3-methoxypropylamino)-4-oxo-butanoic acid CAS Name: 4-(5-chloro-2-methylanilino)-2-(3-methoxypropylamino)-4-oxobutanoic acid IUPAC Name: 4-(5-chloro-2-methylanilino)-2-(3-methoxypropylamino)-4-oxobutanoic acid Traditional Name: 4-(5-chloro-2-methyl-anilino)-4-keto-2-(3-methoxypropylamino)butyric acid Formula: C15H21ClN2O4 MolecularWeight: 328.79124

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21ClN2O4/c1-10-4-5-11(16)8-12(10)18-14(19)9-13(15(20)21)17-6-3-7-22-2/h4-5,8,13,17H,3,6-7,9H2,1-2H3,(H,18,19)(H,20,21)