2-(4-methylpiperazin-4-ium-1-yl)-6-propan-2-yl-pyrimidine-4-carboxylate

Systemtic Name: 2-(4-methylpiperazin-4-ium-1-yl)-6-propan-2-yl-pyrimidine-4-carboxylate Openeye Name: 6-isopropyl-2-(4-methylpiperazin-4-ium-1-yl)pyrimidine-4-carboxylate CAS Name: 2-(4-methyl-1-piperazin-4-iumyl)-6-propan-2-yl-4-pyrimidinecarboxylate IUPAC Name: 2-(4-methylpiperazin-4-ium-1-yl)-6-propan-2-ylpyrimidine-4-carboxylate Traditional Name: 6-isopropyl-2-(4-methylpiperazin-4-ium-1-yl)pyrimidine-4-carboxylate Formula: C13H20N4O2 MolecularWeight: 264.3235

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=NC(=C1)C(=O)[O-])N2CC[NH+](CC2)C

Isomeric SMILES

CC(C)C1=NC(=NC(=C1)C(=O)[O-])N2CC[NH+](CC2)C

InChI

InChI=1S/C13H20N4O2/c1-9(2)10-8-11(12(18)19)15-13(14-10)17-6-4-16(3)5-7-17/h8-9H,4-7H2,1-3H3,(H,18,19)