6-(hydroxymethyl)-2-(3-methoxy-6-pyridin-4-yl-pyridazin-4-yl)indole-1-carboxylic acid

Systemtic Name: 6-(hydroxymethyl)-2-(3-methoxy-6-pyridin-4-yl-pyridazin-4-yl)indole-1-carboxylic acid Openeye Name: 6-(hydroxymethyl)-2-[3-methoxy-6-(4-pyridyl)pyridazin-4-yl]indole-1-carboxylic acid CAS Name: 6-(hydroxymethyl)-2-(3-methoxy-6-pyridin-4-yl-4-pyridazinyl)-1-indolecarboxylic acid IUPAC Name: 6-(hydroxymethyl)-2-(3-methoxy-6-pyridin-4-ylpyridazin-4-yl)indole-1-carboxylic acid Traditional Name: 2-[3-methoxy-6-(4-pyridyl)pyridazin-4-yl]-6-methylol-indole-1-carboxylic acid Formula: C20H16N4O4 MolecularWeight: 376.36544

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NN=C(C=C1C2=CC3=C(N2C(=O)O)C=C(C=C3)CO)C4=CC=NC=C4

Isomeric SMILES

COC1=NN=C(C=C1C2=CC3=C(N2C(=O)O)C=C(C=C3)CO)C4=CC=NC=C4

InChI

InChI=1S/C20H16N4O4/c1-28-19-15(10-16(22-23-19)13-4-6-21-7-5-13)18-9-14-3-2-12(11-25)8-17(14)24(18)20(26)27/h2-10,25H,11H2,1H3,(H,26,27)