7-[2-(2-imidazol-1-ylethoxy)pyrimidin-4-yl]oxy-1-methyl-indole-2-carboxylic acid

Systemtic Name: 7-[2-(2-imidazol-1-ylethoxy)pyrimidin-4-yl]oxy-1-methyl-indole-2-carboxylic acid Openeye Name: 7-[2-(2-imidazol-1-ylethoxy)pyrimidin-4-yl]oxy-1-methyl-indole-2-carboxylic acid CAS Name: 7-[[2-[2-(1-imidazolyl)ethoxy]-4-pyrimidinyl]oxy]-1-methyl-2-indolecarboxylic acid IUPAC Name: 7-[2-(2-imidazol-1-ylethoxy)pyrimidin-4-yl]oxy-1-methylindole-2-carboxylic acid Traditional Name: 7-[2-(2-imidazol-1-ylethoxy)pyrimidin-4-yl]oxy-1-methyl-indole-2-carboxylic acid Formula: C19H17N5O4 MolecularWeight: 379.36938

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC2=C1C(=CC=C2)OC3=NC(=NC=C3)OCCN4C=CN=C4)C(=O)O

Isomeric SMILES

CN1C(=CC2=C1C(=CC=C2)OC3=NC(=NC=C3)OCCN4C=CN=C4)C(=O)O

InChI

InChI=1S/C19H17N5O4/c1-23-14(18(25)26)11-13-3-2-4-15(17(13)23)28-16-5-6-21-19(22-16)27-10-9-24-8-7-20-12-24/h2-8,11-12H,9-10H2,1H3,(H,25,26)