4-(4-methylphenyl)sulfonylbut-2-ynyl furan-2-carboxylate

Systemtic Name: 4-(4-methylphenyl)sulfonylbut-2-ynyl furan-2-carboxylate Openeye Name: 4-(p-tolylsulfonyl)but-2-ynyl furan-2-carboxylate CAS Name: 2-furancarboxylic acid 4-(4-methylphenyl)sulfonylbut-2-ynyl ester IUPAC Name: 4-(4-methylphenyl)sulfonylbut-2-ynyl furan-2-carboxylate Traditional Name: furan-2-carboxylic acid 4-tosylbut-2-ynyl ester Formula: C16H14O5S MolecularWeight: 318.34436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC#CCOC(=O)C2=CC=CO2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC#CCOC(=O)C2=CC=CO2

InChI

InChI=1S/C16H14O5S/c1-13-6-8-14(9-7-13)22(18,19)12-3-2-10-21-16(17)15-5-4-11-20-15/h4-9,11H,10,12H2,1H3