1-[4-[2-(4-dodecylcyclohexyl)ethyl]cyclohexyl]-4-isothiocyanato-benzene

Systemtic Name: 1-[4-[2-(4-dodecylcyclohexyl)ethyl]cyclohexyl]-4-isothiocyanato-benzene Openeye Name: 1-[4-[2-(4-dodecylcyclohexyl)ethyl]cyclohexyl]-4-isothiocyanato-benzene CAS Name: 1-[4-[2-(4-dodecylcyclohexyl)ethyl]cyclohexyl]-4-isothiocyanatobenzene IUPAC Name: 1-[4-[2-(4-dodecylcyclohexyl)ethyl]cyclohexyl]-4-isothiocyanatobenzene Traditional Name: 1-isothiocyanato-4-[4-[2-(4-laurylcyclohexyl)ethyl]cyclohexyl]benzene Formula: C33H53NS MolecularWeight: 495.84562

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1CCC(CC1)CCC2CCC(CC2)C3=CC=C(C=C3)N=C=S

Isomeric SMILES

CCCCCCCCCCCCC1CCC(CC1)CCC2CCC(CC2)C3=CC=C(C=C3)N=C=S

InChI

InChI=1S/C33H53NS/c1-2-3-4-5-6-7-8-9-10-11-12-28-13-15-29(16-14-28)17-18-30-19-21-31(22-20-30)32-23-25-33(26-24-32)34-27-35/h23-26,28-31H,2-22H2,1H3