1-[2-(4-hex-5-enylcyclohexyl)ethyl]-4-isothiocyanato-benzene

Systemtic Name: 1-[2-(4-hex-5-enylcyclohexyl)ethyl]-4-isothiocyanato-benzene Openeye Name: 1-[2-(4-hex-5-enylcyclohexyl)ethyl]-4-isothiocyanato-benzene CAS Name: 1-[2-(4-hex-5-enylcyclohexyl)ethyl]-4-isothiocyanatobenzene IUPAC Name: 1-[2-(4-hex-5-enylcyclohexyl)ethyl]-4-isothiocyanatobenzene Traditional Name: 1-[2-(4-hex-5-enylcyclohexyl)ethyl]-4-isothiocyanato-benzene Formula: C21H29NS MolecularWeight: 327.52666

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCCCC1CCC(CC1)CCC2=CC=C(C=C2)N=C=S

Isomeric SMILES

C=CCCCCC1CCC(CC1)CCC2=CC=C(C=C2)N=C=S

InChI

InChI=1S/C21H29NS/c1-2-3-4-5-6-18-7-9-19(10-8-18)11-12-20-13-15-21(16-14-20)22-17-23/h2,13-16,18-19H,1,3-12H2