1-(1-hexan-3-ylcyclohexyl)-4-isothiocyanato-benzene

Systemtic Name: 1-(1-hexan-3-ylcyclohexyl)-4-isothiocyanato-benzene Openeye Name: 1-[1-(1-ethylbutyl)cyclohexyl]-4-isothiocyanato-benzene CAS Name: 1-(1-hexan-3-ylcyclohexyl)-4-isothiocyanatobenzene IUPAC Name: 1-(1-hexan-3-ylcyclohexyl)-4-isothiocyanatobenzene Traditional Name: 1-[1-(1-ethylbutyl)cyclohexyl]-4-isothiocyanato-benzene Formula: C19H27NS MolecularWeight: 301.48938

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC)C1(CCCCC1)C2=CC=C(C=C2)N=C=S

Isomeric SMILES

CCCC(CC)C1(CCCCC1)C2=CC=C(C=C2)N=C=S

InChI

InChI=1S/C19H27NS/c1-3-8-16(4-2)19(13-6-5-7-14-19)17-9-11-18(12-10-17)20-15-21/h9-12,16H,3-8,13-14H2,1-2H3