3-[3-(4-methylphenyl)propanoylamino]butanoic acid

Systemtic Name: 3-[3-(4-methylphenyl)propanoylamino]butanoic acid Openeye Name: 3-[3-(p-tolyl)propanoylamino]butanoic acid CAS Name: 3-[[3-(4-methylphenyl)-1-oxopropyl]amino]butanoic acid IUPAC Name: 3-[3-(4-methylphenyl)propanoylamino]butanoic acid Traditional Name: 3-[3-(p-tolyl)propanoylamino]butyric acid Formula: C14H19NO3 MolecularWeight: 249.30556

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19NO3/c1-10-3-5-12(6-4-10)7-8-13(16)15-11(2)9-14(17)18/h3-6,11H,7-9H2,1-2H3,(H,15,16)(H,17,18)