1-isothiocyanato-4-[4-(4-nonylcyclohexyl)cyclohexyl]benzene

Systemtic Name: 1-isothiocyanato-4-[4-(4-nonylcyclohexyl)cyclohexyl]benzene Openeye Name: 1-isothiocyanato-4-[4-(4-nonylcyclohexyl)cyclohexyl]benzene CAS Name: 1-isothiocyanato-4-[4-(4-nonylcyclohexyl)cyclohexyl]benzene IUPAC Name: 1-isothiocyanato-4-[4-(4-nonylcyclohexyl)cyclohexyl]benzene Traditional Name: 1-isothiocyanato-4-[4-(4-nonylcyclohexyl)cyclohexyl]benzene Formula: C28H43NS MolecularWeight: 425.71272

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1CCC(CC1)C2CCC(CC2)C3=CC=C(C=C3)N=C=S

Isomeric SMILES

CCCCCCCCCC1CCC(CC1)C2CCC(CC2)C3=CC=C(C=C3)N=C=S

InChI

InChI=1S/C28H43NS/c1-2-3-4-5-6-7-8-9-23-10-12-24(13-11-23)25-14-16-26(17-15-25)27-18-20-28(21-19-27)29-22-30/h18-21,23-26H,2-17H2,1H3