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

Systemtic Name: 3-[3-(2,4-dichlorophenyl)propanoylamino]butanoic acid Openeye Name: 3-[3-(2,4-dichlorophenyl)propanoylamino]butanoic acid CAS Name: 3-[[3-(2,4-dichlorophenyl)-1-oxopropyl]amino]butanoic acid IUPAC Name: 3-[3-(2,4-dichlorophenyl)propanoylamino]butanoic acid Traditional Name: 3-[3-(2,4-dichlorophenyl)propanoylamino]butyric acid Formula: C13H15Cl2NO3 MolecularWeight: 304.1691

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15Cl2NO3/c1-8(6-13(18)19)16-12(17)5-3-9-2-4-10(14)7-11(9)15/h2,4,7-8H,3,5-6H2,1H3,(H,16,17)(H,18,19)