4-cyano-4-(3-cyanophenyl)-5-methyl-hexanoic acid

Systemtic Name: 4-cyano-4-(3-cyanophenyl)-5-methyl-hexanoic acid Openeye Name: 4-cyano-4-(3-cyanophenyl)-5-methyl-hexanoic acid CAS Name: 4-cyano-4-(3-cyanophenyl)-5-methylhexanoic acid IUPAC Name: 4-cyano-4-(3-cyanophenyl)-5-methylhexanoic acid Traditional Name: 4-cyano-4-(3-cyanophenyl)-5-methyl-hexanoic acid Formula: C15H16N2O2 MolecularWeight: 256.29974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H16N2O2/c1-11(2)15(10-17,7-6-14(18)19)13-5-3-4-12(8-13)9-16/h3-5,8,11H,6-7H2,1-2H3,(H,18,19)