3-[3-(cyclohexen-1-yl)prop-2-ynylsulfanyl]prop-1-ynylbenzene

Systemtic Name: 3-[3-(cyclohexen-1-yl)prop-2-ynylsulfanyl]prop-1-ynylbenzene Openeye Name: 3-[3-(cyclohexen-1-yl)prop-2-ynylsulfanyl]prop-1-ynylbenzene CAS Name: 3-[3-(1-cyclohexenyl)prop-2-ynylthio]prop-1-ynylbenzene IUPAC Name: 3-[3-(cyclohexen-1-yl)prop-2-ynylsulfanyl]prop-1-ynylbenzene Traditional Name: 3-[3-(cyclohexen-1-yl)prop-2-ynylthio]prop-1-ynylbenzene Formula: C18H18S MolecularWeight: 266.40052

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)C#CCSCC#CC2=CC=CC=C2

Isomeric SMILES

C1CCC(=CC1)C#CCSCC#CC2=CC=CC=C2

InChI

InChI=1S/C18H18S/c1-3-9-17(10-4-1)13-7-15-19-16-8-14-18-11-5-2-6-12-18/h1,3-4,9-11H,2,5-6,12,15-16H2