3-(2-cyanophenyl)-2-[4-(2-methylbutyl)cyclohexyl]benzoic acid

Systemtic Name: 3-(2-cyanophenyl)-2-[4-(2-methylbutyl)cyclohexyl]benzoic acid Openeye Name: 3-(2-cyanophenyl)-2-[4-(2-methylbutyl)cyclohexyl]benzoic acid CAS Name: 3-(2-cyanophenyl)-2-[4-(2-methylbutyl)cyclohexyl]benzoic acid IUPAC Name: 3-(2-cyanophenyl)-2-[4-(2-methylbutyl)cyclohexyl]benzoic acid Traditional Name: 3-(2-cyanophenyl)-2-[4-(2-methylbutyl)cyclohexyl]benzoic acid Formula: C25H29NO2 MolecularWeight: 375.50326

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC1CCC(CC1)C2=C(C=CC=C2C(=O)O)C3=CC=CC=C3C#N

Isomeric SMILES

CCC(C)CC1CCC(CC1)C2=C(C=CC=C2C(=O)O)C3=CC=CC=C3C#N

InChI

InChI=1S/C25H29NO2/c1-3-17(2)15-18-11-13-19(14-12-18)24-22(9-6-10-23(24)25(27)28)21-8-5-4-7-20(21)16-26/h4-10,17-19H,3,11-15H2,1-2H3,(H,27,28)