2-[(2,4-dimethylphenyl)-(2-ethylbutanoyl)amino]ethanoate

Systemtic Name: 2-[(2,4-dimethylphenyl)-(2-ethylbutanoyl)amino]ethanoate Openeye Name: 2-[N-(2-ethylbutanoyl)-2,4-dimethyl-anilino]acetate CAS Name: 2-(N-(2-ethyl-1-oxobutyl)-2,4-dimethylanilino)acetate IUPAC Name: 2-[N-(2-ethylbutanoyl)-2,4-dimethylanilino]acetate Traditional Name: 2-[N-(2-ethylbutanoyl)-2,4-dimethyl-anilino]acetate Formula: C16H22NO3- MolecularWeight: 276.35078

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23NO3/c1-5-13(6-2)16(20)17(10-15(18)19)14-8-7-11(3)9-12(14)4/h7-9,13H,5-6,10H2,1-4H3,(H,18,19)/p-1