10-(1,3-benzodioxol-5-yl)-1-ethyl-9,10-dihydro-4H-indolizino[6,7-b]indole-2,3-dicarboxylic acid

Systemtic Name: 10-(1,3-benzodioxol-5-yl)-1-ethyl-9,10-dihydro-4H-indolizino[6,7-b]indole-2,3-dicarboxylic acid Openeye Name: 10-(1,3-benzodioxol-5-yl)-1-ethyl-9,10-dihydro-4H-indolizino[6,7-b]indole-2,3-dicarboxylic acid CAS Name: 10-(1,3-benzodioxol-5-yl)-1-ethyl-9,10-dihydro-4H-indolizino[6,7-b]indole-2,3-dicarboxylic acid IUPAC Name: 10-(1,3-benzodioxol-5-yl)-1-ethyl-9,10-dihydro-4H-indolizino[6,7-b]indole-2,3-dicarboxylic acid Traditional Name: 10-(1,3-benzodioxol-5-yl)-1-ethyl-9,10-dihydro-4H-pyrrolo[1,2-b]$b-carboline-2,3-dicarboxylic acid Formula: C25H20N2O6 MolecularWeight: 444.4361

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C2N1C(C3=C(C2)C4=CC=CC=C4N3)C5=CC6=C(C=C5)OCO6)C(=O)O)C(=O)O

Isomeric SMILES

CCC1=C(C(=C2N1C(C3=C(C2)C4=CC=CC=C4N3)C5=CC6=C(C=C5)OCO6)C(=O)O)C(=O)O

InChI

InChI=1S/C25H20N2O6/c1-2-16-20(24(28)29)21(25(30)31)17-10-14-13-5-3-4-6-15(13)26-22(14)23(27(16)17)12-7-8-18-19(9-12)33-11-32-18/h3-9,23,26H,2,10-11H2,1H3,(H,28,29)(H,30,31)