2-(4-methylpiperazin-1-yl)-4-phenyl-pyrimidine-5-carboxylic acid

Systemtic Name: 2-(4-methylpiperazin-1-yl)-4-phenyl-pyrimidine-5-carboxylic acid Openeye Name: 2-(4-methylpiperazin-1-yl)-4-phenyl-pyrimidine-5-carboxylic acid CAS Name: 2-(4-methyl-1-piperazinyl)-4-phenyl-5-pyrimidinecarboxylic acid IUPAC Name: 2-(4-methylpiperazin-1-yl)-4-phenylpyrimidine-5-carboxylic acid Traditional Name: 2-(4-methylpiperazino)-4-phenyl-pyrimidine-5-carboxylic acid Formula: C16H18N4O2 MolecularWeight: 298.33972

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC=C(C(=N2)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CN1CCN(CC1)C2=NC=C(C(=N2)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C16H18N4O2/c1-19-7-9-20(10-8-19)16-17-11-13(15(21)22)14(18-16)12-5-3-2-4-6-12/h2-6,11H,7-10H2,1H3,(H,21,22)