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

Systemtic Name: 3-[(2,4-dimethylphenyl)-(2-ethylbutanoyl)amino]propanoic acid Openeye Name: 3-[N-(2-ethylbutanoyl)-2,4-dimethyl-anilino]propanoic acid CAS Name: 3-(N-(2-ethyl-1-oxobutyl)-2,4-dimethylanilino)propanoic acid IUPAC Name: 3-[N-(2-ethylbutanoyl)-2,4-dimethylanilino]propanoic acid Traditional Name: 3-[N-(2-ethylbutanoyl)-2,4-dimethyl-anilino]propionic acid Formula: C17H25NO3 MolecularWeight: 291.3853

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25NO3/c1-5-14(6-2)17(21)18(10-9-16(19)20)15-8-7-12(3)11-13(15)4/h7-8,11,14H,5-6,9-10H2,1-4H3,(H,19,20)