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

Systemtic Name: 1-isothiocyanato-4-[4-[4-(4-undecylcyclohexyl)cyclohexyl]cyclohexyl]benzene Openeye Name: 1-isothiocyanato-4-[4-[4-(4-undecylcyclohexyl)cyclohexyl]cyclohexyl]benzene CAS Name: 1-isothiocyanato-4-[4-[4-(4-undecylcyclohexyl)cyclohexyl]cyclohexyl]benzene IUPAC Name: 1-isothiocyanato-4-[4-[4-(4-undecylcyclohexyl)cyclohexyl]cyclohexyl]benzene Traditional Name: 1-isothiocyanato-4-[4-[4-(4-undecylcyclohexyl)cyclohexyl]cyclohexyl]benzene Formula: C36H57NS MolecularWeight: 535.90948

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC1CCC(CC1)C2CCC(CC2)C3CCC(CC3)C4=CC=C(C=C4)N=C=S

Isomeric SMILES

CCCCCCCCCCCC1CCC(CC1)C2CCC(CC2)C3CCC(CC3)C4=CC=C(C=C4)N=C=S

InChI

InChI=1S/C36H57NS/c1-2-3-4-5-6-7-8-9-10-11-29-12-14-30(15-13-29)31-16-18-32(19-17-31)33-20-22-34(23-21-33)35-24-26-36(27-25-35)37-28-38/h24-27,29-34H,2-23H2,1H3