7-[2-[[3-(dimethylamino)pyrrolidin-1-yl]methyl]pyrimidin-4-yl]oxy-1-methyl-indole-2-carboxylic acid

Systemtic Name: 7-[2-[[3-(dimethylamino)pyrrolidin-1-yl]methyl]pyrimidin-4-yl]oxy-1-methyl-indole-2-carboxylic acid Openeye Name: 7-[2-[[3-(dimethylamino)pyrrolidin-1-yl]methyl]pyrimidin-4-yl]oxy-1-methyl-indole-2-carboxylic acid CAS Name: 7-[[2-[[3-(dimethylamino)-1-pyrrolidinyl]methyl]-4-pyrimidinyl]oxy]-1-methyl-2-indolecarboxylic acid IUPAC Name: 7-[2-[[3-(dimethylamino)pyrrolidin-1-yl]methyl]pyrimidin-4-yl]oxy-1-methylindole-2-carboxylic acid Traditional Name: 7-[2-[[3-(dimethylamino)pyrrolidino]methyl]pyrimidin-4-yl]oxy-1-methyl-indole-2-carboxylic acid Formula: C21H25N5O3 MolecularWeight: 395.4549

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC2=C1C(=CC=C2)OC3=NC(=NC=C3)CN4CCC(C4)N(C)C)C(=O)O

Isomeric SMILES

CN1C(=CC2=C1C(=CC=C2)OC3=NC(=NC=C3)CN4CCC(C4)N(C)C)C(=O)O

InChI

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