(E)-7-(4,4-dimethyl-2-phenyl-cyclohexyl)hept-5-enoic acid

Systemtic Name: (E)-7-(4,4-dimethyl-2-phenyl-cyclohexyl)hept-5-enoic acid Openeye Name: (E)-7-(4,4-dimethyl-2-phenyl-cyclohexyl)hept-5-enoic acid CAS Name: (E)-7-(4,4-dimethyl-2-phenylcyclohexyl)-5-heptenoic acid IUPAC Name: (E)-7-(4,4-dimethyl-2-phenylcyclohexyl)hept-5-enoic acid Traditional Name: (E)-7-(4,4-dimethyl-2-phenyl-cyclohexyl)hept-5-enoic acid Formula: C21H30O2 MolecularWeight: 314.4617

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(C(C1)C2=CC=CC=C2)CC=CCCCC(=O)O)C

Isomeric SMILES

CC1(CCC(C(C1)C2=CC=CC=C2)C/C=C/CCCC(=O)O)C

InChI

InChI=1S/C21H30O2/c1-21(2)15-14-18(12-6-3-4-9-13-20(22)23)19(16-21)17-10-7-5-8-11-17/h3,5-8,10-11,18-19H,4,9,12-16H2,1-2H3,(H,22,23)/b6-3+