3-[(5-ethoxycarbonyl-1-methyl-pyrrol-3-yl)sulfonylamino]propanoic acid

Systemtic Name: 3-[(5-ethoxycarbonyl-1-methyl-pyrrol-3-yl)sulfonylamino]propanoic acid Openeye Name: 3-[(5-ethoxycarbonyl-1-methyl-pyrrol-3-yl)sulfonylamino]propanoic acid CAS Name: 3-[(5-ethoxycarbonyl-1-methyl-3-pyrrolyl)sulfonylamino]propanoic acid IUPAC Name: 3-[(5-ethoxycarbonyl-1-methylpyrrol-3-yl)sulfonylamino]propanoic acid Traditional Name: 3-[(5-carbethoxy-1-methyl-pyrrol-3-yl)sulfonylamino]propionic acid Formula: C11H16N2O6S MolecularWeight: 304.31954

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H16N2O6S/c1-3-19-11(16)9-6-8(7-13(9)2)20(17,18)12-5-4-10(14)15/h6-7,12H,3-5H2,1-2H3,(H,14,15)