N-(4-ethanoylphenyl)-3-oxidanylidene-5-[[(2R)-oxolan-2-yl]methyl]-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide

Systemtic Name: N-(4-ethanoylphenyl)-3-oxidanylidene-5-[[(2R)-oxolan-2-yl]methyl]-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Openeye Name: N-(4-acetylphenyl)-3-oxo-2-phenyl-5-[[(2R)-tetrahydrofuran-2-yl]methyl]-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide CAS Name: N-(4-acetylphenyl)-3-oxo-5-[[(2R)-2-oxolanyl]methyl]-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide IUPAC Name: N-(4-acetylphenyl)-3-oxo-5-[[(2R)-oxolan-2-yl]methyl]-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Traditional Name: N-(4-acetylphenyl)-3-keto-2-phenyl-5-[[(2R)-tetrahydrofuran-2-yl]methyl]-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Formula: C26H25N4O4+ MolecularWeight: 457.5011

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)NC(=O)C2=C3C(=C[N+](=C2)CC4CCCO4)C(=O)N(N3)C5=CC=CC=C5

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)NC(=O)C2=C3C(=C[N+](=C2)C[C@H]4CCCO4)C(=O)N(N3)C5=CC=CC=C5

InChI

InChI=1S/C26H24N4O4/c1-17(31)18-9-11-19(12-10-18)27-25(32)22-15-29(14-21-8-5-13-34-21)16-23-24(22)28-30(26(23)33)20-6-3-2-4-7-20/h2-4,6-7,9-12,15-16,21H,5,8,13-14H2,1H3,(H,27,31,32)/p+1/t21-/m1/s1