2-[(3-ethoxycarbonyl-5-methyl-thiophen-2-yl)amino]cyclopropane-1,1-dicarboxylic acid

Systemtic Name: 2-[(3-ethoxycarbonyl-5-methyl-thiophen-2-yl)amino]cyclopropane-1,1-dicarboxylic acid Openeye Name: 2-[(3-ethoxycarbonyl-5-methyl-2-thienyl)amino]cyclopropane-1,1-dicarboxylic acid CAS Name: 2-[(3-ethoxycarbonyl-5-methyl-2-thiophenyl)amino]cyclopropane-1,1-dicarboxylic acid IUPAC Name: 2-[(3-ethoxycarbonyl-5-methylthiophen-2-yl)amino]cyclopropane-1,1-dicarboxylic acid Traditional Name: 2-[(3-carbethoxy-5-methyl-2-thienyl)amino]cyclopropane-1,1-dicarboxylic acid Formula: C13H15NO6S MolecularWeight: 313.3263

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C)NC2CC2(C(=O)O)C(=O)O

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C)NC2CC2(C(=O)O)C(=O)O

InChI

InChI=1S/C13H15NO6S/c1-3-20-10(15)7-4-6(2)21-9(7)14-8-5-13(8,11(16)17)12(18)19/h4,8,14H,3,5H2,1-2H3,(H,16,17)(H,18,19)