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

Systemtic Name: 2-[3-methylbutanoyl-(4-propan-2-ylphenyl)amino]ethanoic acid Openeye Name: 2-[4-isopropyl-N-(3-methylbutanoyl)anilino]acetic acid CAS Name: 2-(N-(3-methyl-1-oxobutyl)-4-propan-2-ylanilino)acetic acid IUPAC Name: 2-[N-(3-methylbutanoyl)-4-propan-2-ylanilino]acetic acid Traditional Name: 2-(4-isopropyl-N-isovaleryl-anilino)acetic acid Formula: C16H23NO3 MolecularWeight: 277.35872

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23NO3/c1-11(2)9-15(18)17(10-16(19)20)14-7-5-13(6-8-14)12(3)4/h5-8,11-12H,9-10H2,1-4H3,(H,19,20)