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

Systemtic Name: 1-methyl-7-[2-[methyl-(1-methylpiperidin-4-yl)amino]pyrimidin-4-yl]oxy-indole-2-carboxylic acid Openeye Name: 1-methyl-7-[2-[methyl-(1-methyl-4-piperidyl)amino]pyrimidin-4-yl]oxy-indole-2-carboxylic acid CAS Name: 1-methyl-7-[[2-[methyl-(1-methyl-4-piperidinyl)amino]-4-pyrimidinyl]oxy]-2-indolecarboxylic acid IUPAC Name: 1-methyl-7-[2-[methyl-(1-methylpiperidin-4-yl)amino]pyrimidin-4-yl]oxyindole-2-carboxylic acid Traditional Name: 1-methyl-7-[2-[methyl-(1-methyl-4-piperidyl)amino]pyrimidin-4-yl]oxy-indole-2-carboxylic acid Formula: C21H25N5O3 MolecularWeight: 395.4549

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)N(C)C2=NC=CC(=N2)OC3=CC=CC4=C3N(C(=C4)C(=O)O)C

Isomeric SMILES

CN1CCC(CC1)N(C)C2=NC=CC(=N2)OC3=CC=CC4=C3N(C(=C4)C(=O)O)C

InChI

InChI=1S/C21H25N5O3/c1-24-11-8-15(9-12-24)25(2)21-22-10-7-18(23-21)29-17-6-4-5-14-13-16(20(27)28)26(3)19(14)17/h4-7,10,13,15H,8-9,11-12H2,1-3H3,(H,27,28)