1-(5-ethoxycarbonyl-1-methyl-pyrrol-3-yl)sulfonylpyrrolidine-2-carboxylic acid

Systemtic Name: 1-(5-ethoxycarbonyl-1-methyl-pyrrol-3-yl)sulfonylpyrrolidine-2-carboxylic acid Openeye Name: 1-(5-ethoxycarbonyl-1-methyl-pyrrol-3-yl)sulfonylpyrrolidine-2-carboxylic acid CAS Name: 1-[(5-ethoxycarbonyl-1-methyl-3-pyrrolyl)sulfonyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(5-ethoxycarbonyl-1-methylpyrrol-3-yl)sulfonylpyrrolidine-2-carboxylic acid Traditional Name: 1-(5-carbethoxy-1-methyl-pyrrol-3-yl)sulfonylproline Formula: C13H18N2O6S MolecularWeight: 330.35682

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CN1C)S(=O)(=O)N2CCCC2C(=O)O

Isomeric SMILES

CCOC(=O)C1=CC(=CN1C)S(=O)(=O)N2CCCC2C(=O)O

InChI

InChI=1S/C13H18N2O6S/c1-3-21-13(18)11-7-9(8-14(11)2)22(19,20)15-6-4-5-10(15)12(16)17/h7-8,10H,3-6H2,1-2H3,(H,16,17)