2-methyl-4-[(1-methylpiperidin-1-ium-4-yl)carbamoyl]pyrazole-3-carboxylate

Systemtic Name: 2-methyl-4-[(1-methylpiperidin-1-ium-4-yl)carbamoyl]pyrazole-3-carboxylate Openeye Name: 2-methyl-4-[(1-methylpiperidin-1-ium-4-yl)carbamoyl]pyrazole-3-carboxylate CAS Name: 2-methyl-4-[[(1-methyl-4-piperidin-1-iumyl)amino]-oxomethyl]-3-pyrazolecarboxylate IUPAC Name: 2-methyl-4-[(1-methylpiperidin-1-ium-4-yl)carbamoyl]pyrazole-3-carboxylate Traditional Name: 2-methyl-4-[(1-methylpiperidin-1-ium-4-yl)carbamoyl]pyrazole-3-carboxylate Formula: C12H18N4O3 MolecularWeight: 266.29632

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)NC(=O)C2=C(N(N=C2)C)C(=O)[O-]

Isomeric SMILES

C[NH+]1CCC(CC1)NC(=O)C2=C(N(N=C2)C)C(=O)[O-]

InChI

InChI=1S/C12H18N4O3/c1-15-5-3-8(4-6-15)14-11(17)9-7-13-16(2)10(9)12(18)19/h7-8H,3-6H2,1-2H3,(H,14,17)(H,18,19)