1-(2-butyl-2-ethynyl-hexyl)sulfinyl-4-chloranyl-benzene

Systemtic Name: 1-(2-butyl-2-ethynyl-hexyl)sulfinyl-4-chloranyl-benzene Openeye Name: 1-(2-butyl-2-ethynyl-hexyl)sulfinyl-4-chloro-benzene CAS Name: 1-(2-butyl-2-ethynylhexyl)sulfinyl-4-chlorobenzene IUPAC Name: 1-(2-butyl-2-ethynylhexyl)sulfinyl-4-chlorobenzene Traditional Name: 1-chloro-4-(2,2-dibutylbut-3-ynylsulfinyl)benzene Formula: C18H25ClOS MolecularWeight: 324.9085

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCCC)(CS(=O)C1=CC=C(C=C1)Cl)C#C

Isomeric SMILES

CCCCC(CCCC)(CS(=O)C1=CC=C(C=C1)Cl)C#C

InChI

InChI=1S/C18H25ClOS/c1-4-7-13-18(6-3,14-8-5-2)15-21(20)17-11-9-16(19)10-12-17/h3,9-12H,4-5,7-8,13-15H2,1-2H3