1-(4-dodecylcyclohexyl)-4-(4-isothiocyanatophenyl)benzene

Systemtic Name: 1-(4-dodecylcyclohexyl)-4-(4-isothiocyanatophenyl)benzene Openeye Name: 1-(4-dodecylcyclohexyl)-4-(4-isothiocyanatophenyl)benzene CAS Name: 1-(4-dodecylcyclohexyl)-4-(4-isothiocyanatophenyl)benzene IUPAC Name: 1-(4-dodecylcyclohexyl)-4-(4-isothiocyanatophenyl)benzene Traditional Name: 1-isothiocyanato-4-[4-(4-laurylcyclohexyl)phenyl]benzene Formula: C31H43NS MolecularWeight: 461.74482

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)N=C=S

Isomeric SMILES

CCCCCCCCCCCCC1CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)N=C=S

InChI

InChI=1S/C31H43NS/c1-2-3-4-5-6-7-8-9-10-11-12-26-13-15-27(16-14-26)28-17-19-29(20-18-28)30-21-23-31(24-22-30)32-25-33/h17-24,26-27H,2-16H2,1H3