5-[5-[1-(1H-indol-3-yl)-3-oxidanyl-propan-2-yl]oxypyridin-3-yl]-3-methyl-indazole-1-carboxylic acid

Systemtic Name: 5-[5-[1-(1H-indol-3-yl)-3-oxidanyl-propan-2-yl]oxypyridin-3-yl]-3-methyl-indazole-1-carboxylic acid Openeye Name: 5-[5-[1-(hydroxymethyl)-2-(1H-indol-3-yl)ethoxy]-3-pyridyl]-3-methyl-indazole-1-carboxylic acid CAS Name: 5-[5-[1-hydroxy-3-(1H-indol-3-yl)propan-2-yl]oxy-3-pyridinyl]-3-methyl-1-indazolecarboxylic acid IUPAC Name: 5-[5-[1-hydroxy-3-(1H-indol-3-yl)propan-2-yl]oxypyridin-3-yl]-3-methylindazole-1-carboxylic acid Traditional Name: 5-[5-[2-hydroxy-1-(1H-indol-3-ylmethyl)ethoxy]-3-pyridyl]-3-methyl-indazole-1-carboxylic acid Formula: C25H22N4O4 MolecularWeight: 442.46658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(C=C2)C3=CC(=CN=C3)OC(CC4=CNC5=CC=CC=C54)CO)C(=O)O

Isomeric SMILES

CC1=NN(C2=C1C=C(C=C2)C3=CC(=CN=C3)OC(CC4=CNC5=CC=CC=C54)CO)C(=O)O

InChI

InChI=1S/C25H22N4O4/c1-15-22-10-16(6-7-24(22)29(28-15)25(31)32)17-8-19(13-26-11-17)33-20(14-30)9-18-12-27-23-5-3-2-4-21(18)23/h2-8,10-13,20,27,30H,9,14H2,1H3,(H,31,32)