phenylsulfanyl 4-hexylcyclohexane-1-carboxylate

Systemtic Name: phenylsulfanyl 4-hexylcyclohexane-1-carboxylate Openeye Name: phenylsulfanyl 4-hexylcyclohexanecarboxylate CAS Name: 4-hexyl-1-cyclohexanecarboxylic acid (phenylthio) ester IUPAC Name: phenylsulfanyl 4-hexylcyclohexane-1-carboxylate Traditional Name: 4-hexylcyclohexanecarboxylic acid (phenylthio) ester Formula: C19H28O2S MolecularWeight: 320.48942

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CCC(CC1)C(=O)OSC2=CC=CC=C2

Isomeric SMILES

CCCCCCC1CCC(CC1)C(=O)OSC2=CC=CC=C2

InChI

InChI=1S/C19H28O2S/c1-2-3-4-6-9-16-12-14-17(15-13-16)19(20)21-22-18-10-7-5-8-11-18/h5,7-8,10-11,16-17H,2-4,6,9,12-15H2,1H3