phenacyl 4-pyrrolidin-1-ylsulfonylthiophene-2-carboxylate

Systemtic Name: phenacyl 4-pyrrolidin-1-ylsulfonylthiophene-2-carboxylate Openeye Name: phenacyl 4-pyrrolidin-1-ylsulfonylthiophene-2-carboxylate CAS Name: 4-(1-pyrrolidinylsulfonyl)-2-thiophenecarboxylic acid phenacyl ester IUPAC Name: phenacyl 4-pyrrolidin-1-ylsulfonylthiophene-2-carboxylate Traditional Name: 4-pyrrolidinosulfonylthiophene-2-carboxylic acid phenacyl ester Formula: C17H17NO5S2 MolecularWeight: 379.45058

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CSC(=C2)C(=O)OCC(=O)C3=CC=CC=C3

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CSC(=C2)C(=O)OCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H17NO5S2/c19-15(13-6-2-1-3-7-13)11-23-17(20)16-10-14(12-24-16)25(21,22)18-8-4-5-9-18/h1-3,6-7,10,12H,4-5,8-9,11H2