2-[3-(3-chloranyl-4-methyl-phenyl)propanoylamino]-3-oxidanyl-butanoic acid

Systemtic Name: 2-[3-(3-chloranyl-4-methyl-phenyl)propanoylamino]-3-oxidanyl-butanoic acid Openeye Name: 2-[3-(3-chloro-4-methyl-phenyl)propanoylamino]-3-hydroxy-butanoic acid CAS Name: 2-[[3-(3-chloro-4-methylphenyl)-1-oxopropyl]amino]-3-hydroxybutanoic acid IUPAC Name: 2-[3-(3-chloro-4-methylphenyl)propanoylamino]-3-hydroxybutanoic acid Traditional Name: 2-[3-(3-chloro-4-methyl-phenyl)propanoylamino]-3-hydroxy-butyric acid Formula: C14H18ClNO4 MolecularWeight: 299.75002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CCC(=O)NC(C(C)O)C(=O)O)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)CCC(=O)NC(C(C)O)C(=O)O)Cl

InChI

InChI=1S/C14H18ClNO4/c1-8-3-4-10(7-11(8)15)5-6-12(18)16-13(9(2)17)14(19)20/h3-4,7,9,13,17H,5-6H2,1-2H3,(H,16,18)(H,19,20)