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

Systemtic Name: N-cycloheptyl-5-[(4-fluorophenyl)methyl]-3-oxidanylidene-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Openeye Name: N-cycloheptyl-5-[(4-fluorophenyl)methyl]-3-oxo-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide CAS Name: N-cycloheptyl-5-[(4-fluorophenyl)methyl]-3-oxo-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide IUPAC Name: N-cycloheptyl-5-[(4-fluorophenyl)methyl]-3-oxo-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Traditional Name: N-cycloheptyl-5-(4-fluorobenzyl)-3-keto-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Formula: C27H28FN4O2+ MolecularWeight: 459.535223

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)C2=C3C(=C[N+](=C2)CC4=CC=C(C=C4)F)C(=O)N(N3)C5=CC=CC=C5

Isomeric SMILES

C1CCCC(CC1)NC(=O)C2=C3C(=C[N+](=C2)CC4=CC=C(C=C4)F)C(=O)N(N3)C5=CC=CC=C5

InChI

InChI=1S/C27H27FN4O2/c28-20-14-12-19(13-15-20)16-31-17-23(26(33)29-21-8-4-1-2-5-9-21)25-24(18-31)27(34)32(30-25)22-10-6-3-7-11-22/h3,6-7,10-15,17-18,21H,1-2,4-5,8-9,16H2,(H,29,33)/p+1