4-[2-(8-cyclohexyloxy-5,5-dimethyl-7,8-dihydro-6H-naphthalen-2-yl)ethynyl]benzoic acid

Systemtic Name: 4-[2-(8-cyclohexyloxy-5,5-dimethyl-7,8-dihydro-6H-naphthalen-2-yl)ethynyl]benzoic acid Openeye Name: 4-[2-[4-(cyclohexoxy)-1,1-dimethyl-tetralin-6-yl]ethynyl]benzoic acid CAS Name: 4-[2-(8-cyclohexyloxy-5,5-dimethyl-7,8-dihydro-6H-naphthalen-2-yl)ethynyl]benzoic acid IUPAC Name: 4-[2-(8-cyclohexyloxy-5,5-dimethyl-7,8-dihydro-6H-naphthalen-2-yl)ethynyl]benzoic acid Traditional Name: 4-[2-[4-(cyclohexoxy)-1,1-dimethyl-tetralin-6-yl]ethynyl]benzoic acid Formula: C27H30O3 MolecularWeight: 402.5253

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(C2=C1C=CC(=C2)C#CC3=CC=C(C=C3)C(=O)O)OC4CCCCC4)C

Isomeric SMILES

CC1(CCC(C2=C1C=CC(=C2)C#CC3=CC=C(C=C3)C(=O)O)OC4CCCCC4)C

InChI

InChI=1S/C27H30O3/c1-27(2)17-16-25(30-22-6-4-3-5-7-22)23-18-20(12-15-24(23)27)9-8-19-10-13-21(14-11-19)26(28)29/h10-15,18,22,25H,3-7,16-17H2,1-2H3,(H,28,29)