1-(4-hept-6-enylcyclohexyl)-2-isothiocyanato-benzene

Systemtic Name: 1-(4-hept-6-enylcyclohexyl)-2-isothiocyanato-benzene Openeye Name: 1-(4-hept-6-enylcyclohexyl)-2-isothiocyanato-benzene CAS Name: 1-(4-hept-6-enylcyclohexyl)-2-isothiocyanatobenzene IUPAC Name: 1-(4-hept-6-enylcyclohexyl)-2-isothiocyanatobenzene Traditional Name: 1-(4-hept-6-enylcyclohexyl)-2-isothiocyanato-benzene Formula: C20H27NS MolecularWeight: 313.50008

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCCCCC1CCC(CC1)C2=CC=CC=C2N=C=S

Isomeric SMILES

C=CCCCCCC1CCC(CC1)C2=CC=CC=C2N=C=S

InChI

InChI=1S/C20H27NS/c1-2-3-4-5-6-9-17-12-14-18(15-13-17)19-10-7-8-11-20(19)21-16-22/h2,7-8,10-11,17-18H,1,3-6,9,12-15H2