4-(4-cyanophenyl)-2-methoxycarbonyl-3,3-dimethyl-butanoic acid

Systemtic Name: 4-(4-cyanophenyl)-2-methoxycarbonyl-3,3-dimethyl-butanoic acid Openeye Name: 4-(4-cyanophenyl)-2-methoxycarbonyl-3,3-dimethyl-butanoic acid CAS Name: 4-(4-cyanophenyl)-2-methoxycarbonyl-3,3-dimethylbutanoic acid IUPAC Name: 4-(4-cyanophenyl)-2-methoxycarbonyl-3,3-dimethylbutanoic acid Traditional Name: 2-carbomethoxy-4-(4-cyanophenyl)-3,3-dimethyl-butyric acid Formula: C15H17NO4 MolecularWeight: 275.29978

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC1=CC=C(C=C1)C#N)C(C(=O)O)C(=O)OC

Isomeric SMILES

CC(C)(CC1=CC=C(C=C1)C#N)C(C(=O)O)C(=O)OC

InChI

InChI=1S/C15H17NO4/c1-15(2,12(13(17)18)14(19)20-3)8-10-4-6-11(9-16)7-5-10/h4-7,12H,8H2,1-3H3,(H,17,18)