4-(4-heptan-2-ylcyclohexen-1-yl)benzoic acid

Systemtic Name: 4-(4-heptan-2-ylcyclohexen-1-yl)benzoic acid Openeye Name: 4-[4-(1-methylhexyl)cyclohexen-1-yl]benzoic acid CAS Name: 4-(4-heptan-2-yl-1-cyclohexenyl)benzoic acid IUPAC Name: 4-(4-heptan-2-ylcyclohexen-1-yl)benzoic acid Traditional Name: 4-[4-(1-methylhexyl)cyclohexen-1-yl]benzoic acid Formula: C20H28O2 MolecularWeight: 300.43512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)C1CCC(=CC1)C2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CCCCCC(C)C1CCC(=CC1)C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C20H28O2/c1-3-4-5-6-15(2)16-7-9-17(10-8-16)18-11-13-19(14-12-18)20(21)22/h9,11-16H,3-8,10H2,1-2H3,(H,21,22)