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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)NC(=O)C2=NN(C=C2C(=O)[O-])C

Isomeric SMILES

C[NH+]1CCC(CC1)NC(=O)C2=NN(C=C2C(=O)[O-])C

InChI

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