1-methyl-7-(2-piperazin-1-ylpyrimidin-4-yl)oxy-indole-2-carboxylic acid

Systemtic Name: 1-methyl-7-(2-piperazin-1-ylpyrimidin-4-yl)oxy-indole-2-carboxylic acid Openeye Name: 1-methyl-7-(2-piperazin-1-ylpyrimidin-4-yl)oxy-indole-2-carboxylic acid CAS Name: 1-methyl-7-[[2-(1-piperazinyl)-4-pyrimidinyl]oxy]-2-indolecarboxylic acid IUPAC Name: 1-methyl-7-(2-piperazin-1-ylpyrimidin-4-yl)oxyindole-2-carboxylic acid Traditional Name: 1-methyl-7-(2-piperazinopyrimidin-4-yl)oxy-indole-2-carboxylic acid Formula: C18H19N5O3 MolecularWeight: 353.37516

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC2=C1C(=CC=C2)OC3=NC(=NC=C3)N4CCNCC4)C(=O)O

Isomeric SMILES

CN1C(=CC2=C1C(=CC=C2)OC3=NC(=NC=C3)N4CCNCC4)C(=O)O

InChI

InChI=1S/C18H19N5O3/c1-22-13(17(24)25)11-12-3-2-4-14(16(12)22)26-15-5-6-20-18(21-15)23-9-7-19-8-10-23/h2-6,11,19H,7-10H2,1H3,(H,24,25)