2-[3-(2,4-dichlorophenyl)propanoylamino]-3-methyl-butanoic acid

Systemtic Name: 2-[3-(2,4-dichlorophenyl)propanoylamino]-3-methyl-butanoic acid Openeye Name: 2-[3-(2,4-dichlorophenyl)propanoylamino]-3-methyl-butanoic acid CAS Name: 2-[[3-(2,4-dichlorophenyl)-1-oxopropyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[3-(2,4-dichlorophenyl)propanoylamino]-3-methylbutanoic acid Traditional Name: 2-[3-(2,4-dichlorophenyl)propanoylamino]-3-methyl-butyric acid Formula: C14H17Cl2NO3 MolecularWeight: 318.19568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)CCC1=C(C=C(C=C1)Cl)Cl

Isomeric SMILES

CC(C)C(C(=O)O)NC(=O)CCC1=C(C=C(C=C1)Cl)Cl

InChI

InChI=1S/C14H17Cl2NO3/c1-8(2)13(14(19)20)17-12(18)6-4-9-3-5-10(15)7-11(9)16/h3,5,7-8,13H,4,6H2,1-2H3,(H,17,18)(H,19,20)