[(Z)-8-(phenylsulfonyl)hexadec-7-en-5,9,11-triyn-7-yl]benzene

Systemtic Name: [(Z)-8-(phenylsulfonyl)hexadec-7-en-5,9,11-triyn-7-yl]benzene Openeye Name: [(Z)-2-(benzenesulfonyl)-1-hex-1-ynyl-dec-1-en-3,5-diynyl]benzene CAS Name: [(Z)-8-(benzenesulfonyl)hexadec-7-en-5,9,11-triyn-7-yl]benzene IUPAC Name: [(Z)-8-(benzenesulfonyl)hexadec-7-en-5,9,11-triyn-7-yl]benzene Traditional Name: [(Z)-2-besyl-1-hex-1-ynyl-dec-1-en-3,5-diynyl]benzene Formula: C28H28O2S MolecularWeight: 428.58572

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC#CC(=C(C#CCCCC)C1=CC=CC=C1)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCC#CC#C/C(=C(/C#CCCCC)\C1=CC=CC=C1)/S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C28H28O2S/c1-3-5-7-9-10-18-24-28(31(29,30)26-21-15-12-16-22-26)27(23-17-8-6-4-2)25-19-13-11-14-20-25/h11-16,19-22H,3-8H2,1-2H3/b28-27+