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

Systemtic Name: 2-[(3,4-dimethoxyphenyl)-(3-methylbutanoyl)amino]ethanoic acid Openeye Name: 2-[3,4-dimethoxy-N-(3-methylbutanoyl)anilino]acetic acid CAS Name: 2-(3,4-dimethoxy-N-(3-methyl-1-oxobutyl)anilino)acetic acid IUPAC Name: 2-[3,4-dimethoxy-N-(3-methylbutanoyl)anilino]acetic acid Traditional Name: 2-(N-isovaleryl-3,4-dimethoxy-anilino)acetic acid Formula: C15H21NO5 MolecularWeight: 295.33094

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21NO5/c1-10(2)7-14(17)16(9-15(18)19)11-5-6-12(20-3)13(8-11)21-4/h5-6,8,10H,7,9H2,1-4H3,(H,18,19)