methyl 5-chloranyl-3-[(3S)-3-methylpiperidin-1-yl]sulfonyl-thiophene-2-carboxylate

Systemtic Name: methyl 5-chloranyl-3-[(3S)-3-methylpiperidin-1-yl]sulfonyl-thiophene-2-carboxylate Openeye Name: methyl 5-chloro-3-[[(3S)-3-methyl-1-piperidyl]sulfonyl]thiophene-2-carboxylate CAS Name: 5-chloro-3-[[(3S)-3-methyl-1-piperidinyl]sulfonyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-chloro-3-[(3S)-3-methylpiperidin-1-yl]sulfonylthiophene-2-carboxylate Traditional Name: 5-chloro-3-[(3S)-3-methylpiperidino]sulfonyl-thiophene-2-carboxylic acid methyl ester Formula: C12H16ClNO4S2 MolecularWeight: 337.84274

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=C(SC(=C2)Cl)C(=O)OC

Isomeric SMILES

C[C@H]1CCCN(C1)S(=O)(=O)C2=C(SC(=C2)Cl)C(=O)OC

InChI

InChI=1S/C12H16ClNO4S2/c1-8-4-3-5-14(7-8)20(16,17)9-6-10(13)19-11(9)12(15)18-2/h6,8H,3-5,7H2,1-2H3/t8-/m0/s1