3-[2-ethylbutanoyl-(4-methylphenyl)amino]propanoic acid

Systemtic Name: 3-[2-ethylbutanoyl-(4-methylphenyl)amino]propanoic acid Openeye Name: 3-[N-(2-ethylbutanoyl)-4-methyl-anilino]propanoic acid CAS Name: 3-(N-(2-ethyl-1-oxobutyl)-4-methylanilino)propanoic acid IUPAC Name: 3-[N-(2-ethylbutanoyl)-4-methylanilino]propanoic acid Traditional Name: 3-[N-(2-ethylbutanoyl)-4-methyl-anilino]propionic acid Formula: C16H23NO3 MolecularWeight: 277.35872

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23NO3/c1-4-13(5-2)16(20)17(11-10-15(18)19)14-8-6-12(3)7-9-14/h6-9,13H,4-5,10-11H2,1-3H3,(H,18,19)