1-methyl-4-[4-(4-methylphenyl)-4-sulfonyl-but-2-ynyl]benzene

Systemtic Name: 1-methyl-4-[4-(4-methylphenyl)-4-sulfonyl-but-2-ynyl]benzene Openeye Name: 1-methyl-4-[4-(p-tolyl)-4-sulfonyl-but-2-ynyl]benzene CAS Name: 1-methyl-4-[4-(4-methylphenyl)-4-sulfonylbut-2-ynyl]benzene IUPAC Name: 1-methyl-4-[4-(4-methylphenyl)-4-sulfonylbut-2-ynyl]benzene Traditional Name: 1-methyl-4-[4-(p-tolyl)-4-sulfonyl-but-2-ynyl]benzene Formula: C18H16O2S MolecularWeight: 296.38344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC#CC(=S(=O)=O)C2=CC=C(C=C2)C

Isomeric SMILES

CC1=CC=C(C=C1)CC#CC(=S(=O)=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C18H16O2S/c1-14-6-10-16(11-7-14)4-3-5-18(21(19)20)17-12-8-15(2)9-13-17/h6-13H,4H2,1-2H3