1-isothiocyanato-4-[4-[1-(4-octylcyclohexyl)ethyl]cyclohexyl]benzene

Systemtic Name: 1-isothiocyanato-4-[4-[1-(4-octylcyclohexyl)ethyl]cyclohexyl]benzene Openeye Name: 1-isothiocyanato-4-[4-[1-(4-octylcyclohexyl)ethyl]cyclohexyl]benzene CAS Name: 1-isothiocyanato-4-[4-[1-(4-octylcyclohexyl)ethyl]cyclohexyl]benzene IUPAC Name: 1-isothiocyanato-4-[4-[1-(4-octylcyclohexyl)ethyl]cyclohexyl]benzene Traditional Name: 1-isothiocyanato-4-[4-[1-(4-octylcyclohexyl)ethyl]cyclohexyl]benzene Formula: C29H45NS MolecularWeight: 439.7393

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1CCC(CC1)C(C)C2CCC(CC2)C3=CC=C(C=C3)N=C=S

Isomeric SMILES

CCCCCCCCC1CCC(CC1)C(C)C2CCC(CC2)C3=CC=C(C=C3)N=C=S

InChI

InChI=1S/C29H45NS/c1-3-4-5-6-7-8-9-24-10-12-25(13-11-24)23(2)26-14-16-27(17-15-26)28-18-20-29(21-19-28)30-22-31/h18-21,23-27H,3-17H2,1-2H3