1-[2-(4-hept-6-enylcyclohexyl)ethyl]-4-isothiocyanato-benzene

Systemtic Name: 1-[2-(4-hept-6-enylcyclohexyl)ethyl]-4-isothiocyanato-benzene Openeye Name: 1-[2-(4-hept-6-enylcyclohexyl)ethyl]-4-isothiocyanato-benzene CAS Name: 1-[2-(4-hept-6-enylcyclohexyl)ethyl]-4-isothiocyanatobenzene IUPAC Name: 1-[2-(4-hept-6-enylcyclohexyl)ethyl]-4-isothiocyanatobenzene Traditional Name: 1-[2-(4-hept-6-enylcyclohexyl)ethyl]-4-isothiocyanato-benzene Formula: C22H31NS MolecularWeight: 341.55324

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCCCCC1CCC(CC1)CCC2=CC=C(C=C2)N=C=S

Isomeric SMILES

C=CCCCCCC1CCC(CC1)CCC2=CC=C(C=C2)N=C=S

InChI

InChI=1S/C22H31NS/c1-2-3-4-5-6-7-19-8-10-20(11-9-19)12-13-21-14-16-22(17-15-21)23-18-24/h2,14-17,19-20H,1,3-13H2