7-[2-[1,2-bis(oxidanyl)ethyl]pyrimidin-4-yl]oxy-1-methyl-indole-2-carboxylic acid

Systemtic Name: 7-[2-[1,2-bis(oxidanyl)ethyl]pyrimidin-4-yl]oxy-1-methyl-indole-2-carboxylic acid Openeye Name: 7-[2-(1,2-dihydroxyethyl)pyrimidin-4-yl]oxy-1-methyl-indole-2-carboxylic acid CAS Name: 7-[[2-(1,2-dihydroxyethyl)-4-pyrimidinyl]oxy]-1-methyl-2-indolecarboxylic acid IUPAC Name: 7-[2-(1,2-dihydroxyethyl)pyrimidin-4-yl]oxy-1-methylindole-2-carboxylic acid Traditional Name: 7-[2-(1,2-dihydroxyethyl)pyrimidin-4-yl]oxy-1-methyl-indole-2-carboxylic acid Formula: C16H15N3O5 MolecularWeight: 329.3074

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC2=C1C(=CC=C2)OC3=NC(=NC=C3)C(CO)O)C(=O)O

Isomeric SMILES

CN1C(=CC2=C1C(=CC=C2)OC3=NC(=NC=C3)C(CO)O)C(=O)O

InChI

InChI=1S/C16H15N3O5/c1-19-10(16(22)23)7-9-3-2-4-12(14(9)19)24-13-5-6-17-15(18-13)11(21)8-20/h2-7,11,20-21H,8H2,1H3,(H,22,23)