methyl 3-pyrrolidin-1-ylsulfonyl-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 3-pyrrolidin-1-ylsulfonyl-1-benzothiophene-2-carboxylate Openeye Name: methyl 3-pyrrolidin-1-ylsulfonylbenzothiophene-2-carboxylate CAS Name: 3-(1-pyrrolidinylsulfonyl)-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 3-pyrrolidin-1-ylsulfonyl-1-benzothiophene-2-carboxylate Traditional Name: 3-pyrrolidinosulfonylbenzothiophene-2-carboxylic acid methyl ester Formula: C14H15NO4S2 MolecularWeight: 325.4032

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=CC=CC=C2S1)S(=O)(=O)N3CCCC3

Isomeric SMILES

COC(=O)C1=C(C2=CC=CC=C2S1)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C14H15NO4S2/c1-19-14(16)12-13(10-6-2-3-7-11(10)20-12)21(17,18)15-8-4-5-9-15/h2-3,6-7H,4-5,8-9H2,1H3