1-methyl-7-[2-[(4-methylpiperazin-1-yl)methyl]pyridin-4-yl]oxy-indole-2-carboxylic acid

Systemtic Name: 1-methyl-7-[2-[(4-methylpiperazin-1-yl)methyl]pyridin-4-yl]oxy-indole-2-carboxylic acid Openeye Name: 1-methyl-7-[[2-[(4-methylpiperazin-1-yl)methyl]-4-pyridyl]oxy]indole-2-carboxylic acid CAS Name: 1-methyl-7-[[2-[(4-methyl-1-piperazinyl)methyl]-4-pyridinyl]oxy]-2-indolecarboxylic acid IUPAC Name: 1-methyl-7-[2-[(4-methylpiperazin-1-yl)methyl]pyridin-4-yl]oxyindole-2-carboxylic acid Traditional Name: 1-methyl-7-[[2-[(4-methylpiperazino)methyl]-4-pyridyl]oxy]indole-2-carboxylic acid Formula: C21H24N4O3 MolecularWeight: 380.44026

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2=NC=CC(=C2)OC3=CC=CC4=C3N(C(=C4)C(=O)O)C

Isomeric SMILES

CN1CCN(CC1)CC2=NC=CC(=C2)OC3=CC=CC4=C3N(C(=C4)C(=O)O)C

InChI

InChI=1S/C21H24N4O3/c1-23-8-10-25(11-9-23)14-16-13-17(6-7-22-16)28-19-5-3-4-15-12-18(21(26)27)24(2)20(15)19/h3-7,12-13H,8-11,14H2,1-2H3,(H,26,27)