3-[4-bromanyl-2-[[4-bromanyl-3-(2-carboxyethyl)-5-ethoxycarbonyl-1H-pyrrol-2-yl]methyl]-5-ethoxycarbonyl-1H-pyrrol-3-yl]propanoic acid

Systemtic Name: 3-[4-bromanyl-2-[[4-bromanyl-3-(2-carboxyethyl)-5-ethoxycarbonyl-1H-pyrrol-2-yl]methyl]-5-ethoxycarbonyl-1H-pyrrol-3-yl]propanoic acid Openeye Name: 3-[4-bromo-2-[[4-bromo-3-(2-carboxyethyl)-5-ethoxycarbonyl-1H-pyrrol-2-yl]methyl]-5-ethoxycarbonyl-1H-pyrrol-3-yl]propanoic acid CAS Name: 3-[4-bromo-2-[[4-bromo-3-(2-carboxyethyl)-5-ethoxycarbonyl-1H-pyrrol-2-yl]methyl]-5-ethoxycarbonyl-1H-pyrrol-3-yl]propanoic acid IUPAC Name: 3-[4-bromo-2-[[4-bromo-3-(2-carboxyethyl)-5-ethoxycarbonyl-1H-pyrrol-2-yl]methyl]-5-ethoxycarbonyl-1H-pyrrol-3-yl]propanoic acid Traditional Name: 3-[4-bromo-2-[[4-bromo-5-carbethoxy-3-(2-carboxyethyl)-1H-pyrrol-2-yl]methyl]-5-carbethoxy-1H-pyrrol-3-yl]propionic acid Formula: C21H24Br2N2O8 MolecularWeight: 592.23186

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)CC2=C(C(=C(N2)C(=O)OCC)Br)CCC(=O)O)CCC(=O)O)Br

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)CC2=C(C(=C(N2)C(=O)OCC)Br)CCC(=O)O)CCC(=O)O)Br

InChI

InChI=1S/C21H24Br2N2O8/c1-3-32-20(30)18-16(22)10(5-7-14(26)27)12(24-18)9-13-11(6-8-15(28)29)17(23)19(25-13)21(31)33-4-2/h24-25H,3-9H2,1-2H3,(H,26,27)(H,28,29)