3-[4-(1,4-benzodioxin-3-yl)-1-methyl-2,5-bis(oxidanylidene)pyrrol-3-yl]indole-1-carboxylic acid

Systemtic Name: 3-[4-(1,4-benzodioxin-3-yl)-1-methyl-2,5-bis(oxidanylidene)pyrrol-3-yl]indole-1-carboxylic acid Openeye Name: 3-[4-(1,4-benzodioxin-3-yl)-1-methyl-2,5-dioxo-pyrrol-3-yl]indole-1-carboxylic acid CAS Name: 3-[4-(1,4-benzodioxin-3-yl)-1-methyl-2,5-dioxo-3-pyrrolyl]-1-indolecarboxylic acid IUPAC Name: 3-[4-(1,4-benzodioxin-3-yl)-1-methyl-2,5-dioxopyrrol-3-yl]indole-1-carboxylic acid Traditional Name: 3-[4-(1,4-benzodioxin-3-yl)-2,5-diketo-1-methyl-3-pyrrolin-3-yl]indole-1-carboxylic acid Formula: C22H14N2O6 MolecularWeight: 402.35636

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=C(C1=O)C2=COC3=CC=CC=C3O2)C4=CN(C5=CC=CC=C54)C(=O)O

Isomeric SMILES

CN1C(=O)C(=C(C1=O)C2=COC3=CC=CC=C3O2)C4=CN(C5=CC=CC=C54)C(=O)O

InChI

InChI=1S/C22H14N2O6/c1-23-20(25)18(13-10-24(22(27)28)14-7-3-2-6-12(13)14)19(21(23)26)17-11-29-15-8-4-5-9-16(15)30-17/h2-11H,1H3,(H,27,28)