4-[(3-cyanophenyl)amino]-2-methyl-4-oxidanylidene-2-propan-2-yl-butanoic acid

Systemtic Name: 4-[(3-cyanophenyl)amino]-2-methyl-4-oxidanylidene-2-propan-2-yl-butanoic acid Openeye Name: 4-(3-cyanoanilino)-2-isopropyl-2-methyl-4-oxo-butanoic acid CAS Name: 4-(3-cyanoanilino)-2-methyl-4-oxo-2-propan-2-ylbutanoic acid IUPAC Name: 4-(3-cyanoanilino)-2-methyl-4-oxo-2-propan-2-ylbutanoic acid Traditional Name: 4-(3-cyanoanilino)-2-isopropyl-4-keto-2-methyl-butyric acid Formula: C15H18N2O3 MolecularWeight: 274.31502

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(CC(=O)NC1=CC=CC(=C1)C#N)C(=O)O

Isomeric SMILES

CC(C)C(C)(CC(=O)NC1=CC=CC(=C1)C#N)C(=O)O

InChI

InChI=1S/C15H18N2O3/c1-10(2)15(3,14(19)20)8-13(18)17-12-6-4-5-11(7-12)9-16/h4-7,10H,8H2,1-3H3,(H,17,18)(H,19,20)