1-(2-fluorophenyl)-6-methyl-4-oxidanylidene-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]pyridazine-3-carboxamide

Systemtic Name: 1-(2-fluorophenyl)-6-methyl-4-oxidanylidene-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]pyridazine-3-carboxamide Openeye Name: 1-(2-fluorophenyl)-6-methyl-4-oxo-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]pyridazine-3-carboxamide CAS Name: 1-(2-fluorophenyl)-6-methyl-4-oxo-N-[[2-(1-piperidin-1-iumylmethyl)phenyl]methyl]-3-pyridazinecarboxamide IUPAC Name: 1-(2-fluorophenyl)-6-methyl-4-oxo-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]pyridazine-3-carboxamide Traditional Name: 1-(2-fluorophenyl)-4-keto-6-methyl-N-[2-(piperidin-1-ium-1-ylmethyl)benzyl]pyridazine-3-carboxamide Formula: C25H28FN4O2+ MolecularWeight: 435.513823

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=NN1C2=CC=CC=C2F)C(=O)NCC3=CC=CC=C3C[NH+]4CCCCC4

Isomeric SMILES

CC1=CC(=O)C(=NN1C2=CC=CC=C2F)C(=O)NCC3=CC=CC=C3C[NH+]4CCCCC4

InChI

InChI=1S/C25H27FN4O2/c1-18-15-23(31)24(28-30(18)22-12-6-5-11-21(22)26)25(32)27-16-19-9-3-4-10-20(19)17-29-13-7-2-8-14-29/h3-6,9-12,15H,2,7-8,13-14,16-17H2,1H3,(H,27,32)/p+1