3-[2-(3-methoxyphenyl)pyrrolidin-1-yl]sulfonylthiophene-2-carboxylic acid

Systemtic Name: 3-[2-(3-methoxyphenyl)pyrrolidin-1-yl]sulfonylthiophene-2-carboxylic acid Openeye Name: 3-[2-(3-methoxyphenyl)pyrrolidin-1-yl]sulfonylthiophene-2-carboxylic acid CAS Name: 3-[[2-(3-methoxyphenyl)-1-pyrrolidinyl]sulfonyl]-2-thiophenecarboxylic acid IUPAC Name: 3-[2-(3-methoxyphenyl)pyrrolidin-1-yl]sulfonylthiophene-2-carboxylic acid Traditional Name: 3-[2-(3-methoxyphenyl)pyrrolidino]sulfonyl-2-thenoic acid Formula: C16H17NO5S2 MolecularWeight: 367.43988

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2CCCN2S(=O)(=O)C3=C(SC=C3)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1)C2CCCN2S(=O)(=O)C3=C(SC=C3)C(=O)O

InChI

InChI=1S/C16H17NO5S2/c1-22-12-5-2-4-11(10-12)13-6-3-8-17(13)24(20,21)14-7-9-23-15(14)16(18)19/h2,4-5,7,9-10,13H,3,6,8H2,1H3,(H,18,19)