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

Systemtic Name: 3-[4-(1,4-benzodioxin-3-yl)-1-methyl-2,5-bis(oxidanylidene)pyrrol-3-yl]-5-phenylmethoxy-indole-1-carboxylic acid Openeye Name: 3-[4-(1,4-benzodioxin-3-yl)-1-methyl-2,5-dioxo-pyrrol-3-yl]-5-benzyloxy-indole-1-carboxylic acid CAS Name: 3-[4-(1,4-benzodioxin-3-yl)-1-methyl-2,5-dioxo-3-pyrrolyl]-5-phenylmethoxy-1-indolecarboxylic acid IUPAC Name: 3-[4-(1,4-benzodioxin-3-yl)-1-methyl-2,5-dioxopyrrol-3-yl]-5-phenylmethoxyindole-1-carboxylic acid Traditional Name: 3-[4-(1,4-benzodioxin-3-yl)-2,5-diketo-1-methyl-3-pyrrolin-3-yl]-5-benzoxy-indole-1-carboxylic acid Formula: C29H20N2O7 MolecularWeight: 508.4783

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=C(C1=O)C2=COC3=CC=CC=C3O2)C4=CN(C5=C4C=C(C=C5)OCC6=CC=CC=C6)C(=O)O

Isomeric SMILES

CN1C(=O)C(=C(C1=O)C2=COC3=CC=CC=C3O2)C4=CN(C5=C4C=C(C=C5)OCC6=CC=CC=C6)C(=O)O

InChI

InChI=1S/C29H20N2O7/c1-30-27(32)25(26(28(30)33)24-16-37-22-9-5-6-10-23(22)38-24)20-14-31(29(34)35)21-12-11-18(13-19(20)21)36-15-17-7-3-2-4-8-17/h2-14,16H,15H2,1H3,(H,34,35)