4-[(3,5-dimethylphenyl)amino]-2-methyl-4-oxidanylidene-2-propan-2-yl-butanoic acid

Systemtic Name: 4-[(3,5-dimethylphenyl)amino]-2-methyl-4-oxidanylidene-2-propan-2-yl-butanoic acid Openeye Name: 4-(3,5-dimethylanilino)-2-isopropyl-2-methyl-4-oxo-butanoic acid CAS Name: 4-(3,5-dimethylanilino)-2-methyl-4-oxo-2-propan-2-ylbutanoic acid IUPAC Name: 4-(3,5-dimethylanilino)-2-methyl-4-oxo-2-propan-2-ylbutanoic acid Traditional Name: 4-(3,5-dimethylanilino)-2-isopropyl-4-keto-2-methyl-butyric acid Formula: C16H23NO3 MolecularWeight: 277.35872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)CC(C)(C(C)C)C(=O)O)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)CC(C)(C(C)C)C(=O)O)C

InChI

InChI=1S/C16H23NO3/c1-10(2)16(5,15(19)20)9-14(18)17-13-7-11(3)6-12(4)8-13/h6-8,10H,9H2,1-5H3,(H,17,18)(H,19,20)