(4-sulfanylphenyl) 4-(4-heptylcyclohexyl)cyclohexane-1-carboxylate

Systemtic Name: (4-sulfanylphenyl) 4-(4-heptylcyclohexyl)cyclohexane-1-carboxylate Openeye Name: (4-sulfanylphenyl) 4-(4-heptylcyclohexyl)cyclohexanecarboxylate CAS Name: 4-(4-heptylcyclohexyl)-1-cyclohexanecarboxylic acid (4-mercaptophenyl) ester IUPAC Name: (4-sulfanylphenyl) 4-(4-heptylcyclohexyl)cyclohexane-1-carboxylate Traditional Name: 4-(4-heptylcyclohexyl)cyclohexanecarboxylic acid (4-mercaptophenyl) ester Formula: C26H40O2S MolecularWeight: 416.6596

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(CC1)C2CCC(CC2)C(=O)OC3=CC=C(C=C3)S

Isomeric SMILES

CCCCCCCC1CCC(CC1)C2CCC(CC2)C(=O)OC3=CC=C(C=C3)S

InChI

InChI=1S/C26H40O2S/c1-2-3-4-5-6-7-20-8-10-21(11-9-20)22-12-14-23(15-13-22)26(27)28-24-16-18-25(29)19-17-24/h16-23,29H,2-15H2,1H3