5-[(4-fluorophenyl)methyl]-3-oxidanylidene-N-phenethyl-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide

Systemtic Name: 5-[(4-fluorophenyl)methyl]-3-oxidanylidene-N-phenethyl-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Openeye Name: 5-[(4-fluorophenyl)methyl]-3-oxo-N-phenethyl-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide CAS Name: 5-[(4-fluorophenyl)methyl]-3-oxo-N-phenethyl-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide IUPAC Name: 5-[(4-fluorophenyl)methyl]-3-oxo-N-phenethyl-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Traditional Name: 5-(4-fluorobenzyl)-3-keto-N-phenethyl-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Formula: C28H24FN4O2+ MolecularWeight: 467.514163

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)C2=C3C(=C[N+](=C2)CC4=CC=C(C=C4)F)C(=O)N(N3)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)C2=C3C(=C[N+](=C2)CC4=CC=C(C=C4)F)C(=O)N(N3)C5=CC=CC=C5

InChI

InChI=1S/C28H23FN4O2/c29-22-13-11-21(12-14-22)17-32-18-24(27(34)30-16-15-20-7-3-1-4-8-20)26-25(19-32)28(35)33(31-26)23-9-5-2-6-10-23/h1-14,18-19H,15-17H2,(H,30,34)/p+1