fluoranylsulfanyl 4-(4-octoxyphenyl)cyclohexane-1-carboxylate

Systemtic Name: fluoranylsulfanyl 4-(4-octoxyphenyl)cyclohexane-1-carboxylate Openeye Name: fluorosulfanyl 4-(4-octoxyphenyl)cyclohexanecarboxylate CAS Name: 4-(4-octoxyphenyl)-1-cyclohexanecarboxylic acid (fluorothio) ester IUPAC Name: fluorosulfanyl 4-(4-octoxyphenyl)cyclohexane-1-carboxylate Traditional Name: 4-(4-octoxyphenyl)cyclohexanecarboxylic acid (fluorothio) ester Formula: C21H31FO3S MolecularWeight: 382.532443

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2CCC(CC2)C(=O)OSF

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2CCC(CC2)C(=O)OSF

InChI

InChI=1S/C21H31FO3S/c1-2-3-4-5-6-7-16-24-20-14-12-18(13-15-20)17-8-10-19(11-9-17)21(23)25-26-22/h12-15,17,19H,2-11,16H2,1H3