2-[(4-ethylphenyl)-(3-methylbutanoyl)amino]ethanoic acid

Systemtic Name: 2-[(4-ethylphenyl)-(3-methylbutanoyl)amino]ethanoic acid Openeye Name: 2-[4-ethyl-N-(3-methylbutanoyl)anilino]acetic acid CAS Name: 2-(4-ethyl-N-(3-methyl-1-oxobutyl)anilino)acetic acid IUPAC Name: 2-[4-ethyl-N-(3-methylbutanoyl)anilino]acetic acid Traditional Name: 2-(4-ethyl-N-isovaleryl-anilino)acetic acid Formula: C15H21NO3 MolecularWeight: 263.33214

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N(CC(=O)O)C(=O)CC(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)N(CC(=O)O)C(=O)CC(C)C

InChI

InChI=1S/C15H21NO3/c1-4-12-5-7-13(8-6-12)16(10-15(18)19)14(17)9-11(2)3/h5-8,11H,4,9-10H2,1-3H3,(H,18,19)