N-cyclopentyl-1-methyl-N-[[1-[2-(2-methylphenyl)ethyl]piperidin-1-ium-4-yl]methyl]-6-oxidanylidene-pyridazine-3-carboxamide

Systemtic Name: N-cyclopentyl-1-methyl-N-[[1-[2-(2-methylphenyl)ethyl]piperidin-1-ium-4-yl]methyl]-6-oxidanylidene-pyridazine-3-carboxamide Openeye Name: N-cyclopentyl-1-methyl-N-[[1-[2-(o-tolyl)ethyl]piperidin-1-ium-4-yl]methyl]-6-oxo-pyridazine-3-carboxamide CAS Name: N-cyclopentyl-1-methyl-N-[[1-[2-(2-methylphenyl)ethyl]-4-piperidin-1-iumyl]methyl]-6-oxo-3-pyridazinecarboxamide IUPAC Name: N-cyclopentyl-1-methyl-N-[[1-[2-(2-methylphenyl)ethyl]piperidin-1-ium-4-yl]methyl]-6-oxopyridazine-3-carboxamide Traditional Name: N-cyclopentyl-6-keto-1-methyl-N-[[1-[2-(o-tolyl)ethyl]piperidin-1-ium-4-yl]methyl]pyridazine-3-carboxamide Formula: C26H37N4O2+ MolecularWeight: 437.59758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC[NH+]2CCC(CC2)CN(C3CCCC3)C(=O)C4=NN(C(=O)C=C4)C

Isomeric SMILES

CC1=CC=CC=C1CC[NH+]2CCC(CC2)CN(C3CCCC3)C(=O)C4=NN(C(=O)C=C4)C

InChI

InChI=1S/C26H36N4O2/c1-20-7-3-4-8-22(20)15-18-29-16-13-21(14-17-29)19-30(23-9-5-6-10-23)26(32)24-11-12-25(31)28(2)27-24/h3-4,7-8,11-12,21,23H,5-6,9-10,13-19H2,1-2H3/p+1