3-[butanoyl-(4-methylphenyl)amino]propanoic acid

Systemtic Name: 3-[butanoyl-(4-methylphenyl)amino]propanoic acid Openeye Name: 3-(N-butanoyl-4-methyl-anilino)propanoic acid CAS Name: 3-[4-methyl-N-(1-oxobutyl)anilino]propanoic acid IUPAC Name: 3-(N-butanoyl-4-methylanilino)propanoic acid Traditional Name: 3-(N-butyryl-4-methyl-anilino)propionic acid Formula: C14H19NO3 MolecularWeight: 249.30556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N(CCC(=O)O)C1=CC=C(C=C1)C

Isomeric SMILES

CCCC(=O)N(CCC(=O)O)C1=CC=C(C=C1)C

InChI

InChI=1S/C14H19NO3/c1-3-4-13(16)15(10-9-14(17)18)12-7-5-11(2)6-8-12/h5-8H,3-4,9-10H2,1-2H3,(H,17,18)