methyl 4-[(4-methylphenyl)sulfonylmethyl]thiophene-3-carboxylate

Systemtic Name: methyl 4-[(4-methylphenyl)sulfonylmethyl]thiophene-3-carboxylate Openeye Name: methyl 4-(p-tolylsulfonylmethyl)thiophene-3-carboxylate CAS Name: 4-[(4-methylphenyl)sulfonylmethyl]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-[(4-methylphenyl)sulfonylmethyl]thiophene-3-carboxylate Traditional Name: 4-(tosylmethyl)thiophene-3-carboxylic acid methyl ester Formula: C14H14O4S2 MolecularWeight: 310.38856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC2=CSC=C2C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC2=CSC=C2C(=O)OC

InChI

InChI=1S/C14H14O4S2/c1-10-3-5-12(6-4-10)20(16,17)9-11-7-19-8-13(11)14(15)18-2/h3-8H,9H2,1-2H3