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2-(4-butylcyclohexyl)-3-(4-cyanophenyl)benzoic acid

2-(4-butylcyclohexyl)-3-(4-cyanophenyl)benzoic acid

Systemtic Name:2-(4-butylcyclohexyl)-3-(4-cyanophenyl)benzoic acid
Openeye Name:2-(4-butylcyclohexyl)-3-(4-cyanophenyl)benzoic acid
CAS Name:2-(4-butylcyclohexyl)-3-(4-cyanophenyl)benzoic acid
IUPAC Name:2-(4-butylcyclohexyl)-3-(4-cyanophenyl)benzoic acid
Traditional Name:2-(4-butylcyclohexyl)-3-(4-cyanophenyl)benzoic acid
Formula: C24H27NO2
MolecularWeight: 361.47668
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C2=C(C=CC=C2C(=O)O)C3=CC=C(C=C3)C#N


Isomeric SMILES

CCCCC1CCC(CC1)C2=C(C=CC=C2C(=O)O)C3=CC=C(C=C3)C#N


InChI

InChI=1S/C24H27NO2/c1-2-3-5-17-8-14-20(15-9-17)23-21(6-4-7-22(23)24(26)27)19-12-10-18(16-25)11-13-19/h4,6-7,10-13,17,20H,2-3,5,8-9,14-15H2,1H3,(H,26,27)


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