2-[(4-ethoxycarbonyl-1-ethyl-2,5-dimethyl-pyrrol-3-yl)sulfonylamino]ethanoic acid

Systemtic Name: 2-[(4-ethoxycarbonyl-1-ethyl-2,5-dimethyl-pyrrol-3-yl)sulfonylamino]ethanoic acid Openeye Name: 2-[(4-ethoxycarbonyl-1-ethyl-2,5-dimethyl-pyrrol-3-yl)sulfonylamino]acetic acid CAS Name: 2-[(4-ethoxycarbonyl-1-ethyl-2,5-dimethyl-3-pyrrolyl)sulfonylamino]acetic acid IUPAC Name: 2-[(4-ethoxycarbonyl-1-ethyl-2,5-dimethylpyrrol-3-yl)sulfonylamino]acetic acid Traditional Name: 2-[(4-carbethoxy-1-ethyl-2,5-dimethyl-pyrrol-3-yl)sulfonylamino]acetic acid Formula: C13H20N2O6S MolecularWeight: 332.3727

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=C1C)S(=O)(=O)NCC(=O)O)C(=O)OCC)C

Isomeric SMILES

CCN1C(=C(C(=C1C)S(=O)(=O)NCC(=O)O)C(=O)OCC)C

InChI

InChI=1S/C13H20N2O6S/c1-5-15-8(3)11(13(18)21-6-2)12(9(15)4)22(19,20)14-7-10(16)17/h14H,5-7H2,1-4H3,(H,16,17)