5-(2-chlorophenyl)-2-[(4-methylpiperazin-1-yl)methyl]pyrimidine-4-carboxylic acid

Systemtic Name: 5-(2-chlorophenyl)-2-[(4-methylpiperazin-1-yl)methyl]pyrimidine-4-carboxylic acid Openeye Name: 5-(2-chlorophenyl)-2-[(4-methylpiperazin-1-yl)methyl]pyrimidine-4-carboxylic acid CAS Name: 5-(2-chlorophenyl)-2-[(4-methyl-1-piperazinyl)methyl]-4-pyrimidinecarboxylic acid IUPAC Name: 5-(2-chlorophenyl)-2-[(4-methylpiperazin-1-yl)methyl]pyrimidine-4-carboxylic acid Traditional Name: 5-(2-chlorophenyl)-2-[(4-methylpiperazino)methyl]pyrimidine-4-carboxylic acid Formula: C17H19ClN4O2 MolecularWeight: 346.81136

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2=NC=C(C(=N2)C(=O)O)C3=CC=CC=C3Cl

Isomeric SMILES

CN1CCN(CC1)CC2=NC=C(C(=N2)C(=O)O)C3=CC=CC=C3Cl

InChI

InChI=1S/C17H19ClN4O2/c1-21-6-8-22(9-7-21)11-15-19-10-13(16(20-15)17(23)24)12-4-2-3-5-14(12)18/h2-5,10H,6-9,11H2,1H3,(H,23,24)