2-[4-(4-chloranyl-2-methyl-phenoxy)butanoylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[4-(4-chloranyl-2-methyl-phenoxy)butanoylamino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[4-(4-chloro-2-methyl-phenoxy)butanoylamino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[[4-(4-chloro-2-methylphenoxy)-1-oxobutyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[4-(4-chloro-2-methylphenoxy)butanoylamino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[4-(4-chloro-2-methyl-phenoxy)butanoylamino]-4-(methylthio)butyric acid Formula: C16H22ClNO4S MolecularWeight: 359.86818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCCCC(=O)NC(CCSC)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCCCC(=O)NC(CCSC)C(=O)O

InChI

InChI=1S/C16H22ClNO4S/c1-11-10-12(17)5-6-14(11)22-8-3-4-15(19)18-13(16(20)21)7-9-23-2/h5-6,10,13H,3-4,7-9H2,1-2H3,(H,18,19)(H,20,21)