2-[[(5-bromanyl-3-methoxycarbonyl-thiophen-2-yl)amino]methylidene]propanedioic acid

Systemtic Name: 2-[[(5-bromanyl-3-methoxycarbonyl-thiophen-2-yl)amino]methylidene]propanedioic acid Openeye Name: 2-[[(5-bromo-3-methoxycarbonyl-2-thienyl)amino]methylene]propanedioic acid CAS Name: 2-[[(5-bromo-3-methoxycarbonyl-2-thiophenyl)amino]methylidene]propanedioic acid IUPAC Name: 2-[[(5-bromo-3-methoxycarbonylthiophen-2-yl)amino]methylidene]propanedioic acid Traditional Name: 2-[[(5-bromo-3-carbomethoxy-2-thienyl)amino]methylene]malonic acid Formula: C10H8BrNO6S MolecularWeight: 350.14262

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(=C1)Br)NC=C(C(=O)O)C(=O)O

Isomeric SMILES

COC(=O)C1=C(SC(=C1)Br)NC=C(C(=O)O)C(=O)O

InChI

InChI=1S/C10H8BrNO6S/c1-18-10(17)4-2-6(11)19-7(4)12-3-5(8(13)14)9(15)16/h2-3,12H,1H3,(H,13,14)(H,15,16)