5-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]sulfonylthiophene-3-carboxylic acid

Systemtic Name: 5-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]sulfonylthiophene-3-carboxylic acid Openeye Name: 5-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]sulfonylthiophene-3-carboxylic acid CAS Name: 5-[[2-(4-ethoxyphenyl)-1-pyrrolidinyl]sulfonyl]-3-thiophenecarboxylic acid IUPAC Name: 5-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]sulfonylthiophene-3-carboxylic acid Traditional Name: 5-(2-p-phenetylpyrrolidino)sulfonyl-3-thenoic acid Formula: C17H19NO5S2 MolecularWeight: 381.46646

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2CCCN2S(=O)(=O)C3=CC(=CS3)C(=O)O

Isomeric SMILES

CCOC1=CC=C(C=C1)C2CCCN2S(=O)(=O)C3=CC(=CS3)C(=O)O

InChI

InChI=1S/C17H19NO5S2/c1-2-23-14-7-5-12(6-8-14)15-4-3-9-18(15)25(21,22)16-10-13(11-24-16)17(19)20/h5-8,10-11,15H,2-4,9H2,1H3,(H,19,20)