3-[(3,5-dimethylphenyl)-(2-ethylbutanoyl)amino]propanoate

Systemtic Name: 3-[(3,5-dimethylphenyl)-(2-ethylbutanoyl)amino]propanoate Openeye Name: 3-[N-(2-ethylbutanoyl)-3,5-dimethyl-anilino]propanoate CAS Name: 3-(N-(2-ethyl-1-oxobutyl)-3,5-dimethylanilino)propanoate IUPAC Name: 3-[N-(2-ethylbutanoyl)-3,5-dimethylanilino]propanoate Traditional Name: 3-[N-(2-ethylbutanoyl)-3,5-dimethyl-anilino]propionate Formula: C17H24NO3- MolecularWeight: 290.37736

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)N(CCC(=O)[O-])C1=CC(=CC(=C1)C)C

Isomeric SMILES

CCC(CC)C(=O)N(CCC(=O)[O-])C1=CC(=CC(=C1)C)C

InChI

InChI=1S/C17H25NO3/c1-5-14(6-2)17(21)18(8-7-16(19)20)15-10-12(3)9-13(4)11-15/h9-11,14H,5-8H2,1-4H3,(H,19,20)/p-1