5-[(4-fluorophenyl)methyl]-7-(4-methylpiperazin-1-yl)carbonyl-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-3-one

Systemtic Name: 5-[(4-fluorophenyl)methyl]-7-(4-methylpiperazin-1-yl)carbonyl-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-3-one Openeye Name: 5-[(4-fluorophenyl)methyl]-7-(4-methylpiperazine-1-carbonyl)-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-3-one CAS Name: 5-[(4-fluorophenyl)methyl]-7-[(4-methyl-1-piperazinyl)-oxomethyl]-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-3-one IUPAC Name: 5-[(4-fluorophenyl)methyl]-7-(4-methylpiperazine-1-carbonyl)-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-3-one Traditional Name: 5-(4-fluorobenzyl)-7-(4-methylpiperazine-1-carbonyl)-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-3-one Formula: C25H25FN5O2+ MolecularWeight: 446.496703

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C2=C3C(=C[N+](=C2)CC4=CC=C(C=C4)F)C(=O)N(N3)C5=CC=CC=C5

Isomeric SMILES

CN1CCN(CC1)C(=O)C2=C3C(=C[N+](=C2)CC4=CC=C(C=C4)F)C(=O)N(N3)C5=CC=CC=C5

InChI

InChI=1S/C25H24FN5O2/c1-28-11-13-30(14-12-28)24(32)21-16-29(15-18-7-9-19(26)10-8-18)17-22-23(21)27-31(25(22)33)20-5-3-2-4-6-20/h2-10,16-17H,11-15H2,1H3/p+1