4-[1-(4-carboxyphenyl)-3,3,5-trimethyl-cyclohexyl]benzoic acid

Systemtic Name: 4-[1-(4-carboxyphenyl)-3,3,5-trimethyl-cyclohexyl]benzoic acid Openeye Name: 4-[1-(4-carboxyphenyl)-3,3,5-trimethyl-cyclohexyl]benzoic acid CAS Name: 4-[1-(4-carboxyphenyl)-3,3,5-trimethylcyclohexyl]benzoic acid IUPAC Name: 4-[1-(4-carboxyphenyl)-3,3,5-trimethylcyclohexyl]benzoic acid Traditional Name: 4-[1-(4-carboxyphenyl)-3,3,5-trimethyl-cyclohexyl]benzoic acid Formula: C23H26O4 MolecularWeight: 366.45014

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CC(C1)(C2=CC=C(C=C2)C(=O)O)C3=CC=C(C=C3)C(=O)O)(C)C

Isomeric SMILES

CC1CC(CC(C1)(C2=CC=C(C=C2)C(=O)O)C3=CC=C(C=C3)C(=O)O)(C)C

InChI

InChI=1S/C23H26O4/c1-15-12-22(2,3)14-23(13-15,18-8-4-16(5-9-18)20(24)25)19-10-6-17(7-11-19)21(26)27/h4-11,15H,12-14H2,1-3H3,(H,24,25)(H,26,27)