2-chloranyl-1,3,5-trimethyl-4-oct-1-ynylsulfanyl-benzene

Systemtic Name: 2-chloranyl-1,3,5-trimethyl-4-oct-1-ynylsulfanyl-benzene Openeye Name: 2-chloro-1,3,5-trimethyl-4-oct-1-ynylsulfanyl-benzene CAS Name: 2-chloro-1,3,5-trimethyl-4-(oct-1-ynylthio)benzene IUPAC Name: 2-chloro-1,3,5-trimethyl-4-oct-1-ynylsulfanylbenzene Traditional Name: 2-chloro-1,3,5-trimethyl-4-(oct-1-ynylthio)benzene Formula: C17H23ClS MolecularWeight: 294.88252

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC#CSC1=C(C(=C(C=C1C)C)Cl)C

Isomeric SMILES

CCCCCCC#CSC1=C(C(=C(C=C1C)C)Cl)C

InChI

InChI=1S/C17H23ClS/c1-5-6-7-8-9-10-11-19-17-14(3)12-13(2)16(18)15(17)4/h12H,5-9H2,1-4H3