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

Systemtic Name: N-(2,2-diethoxyethyl)-3-oxidanylidene-2-phenyl-5-(phenylmethyl)-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Openeye Name: 5-benzyl-N-(2,2-diethoxyethyl)-3-oxo-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide CAS Name: N-(2,2-diethoxyethyl)-3-oxo-2-phenyl-5-(phenylmethyl)-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide IUPAC Name: 5-benzyl-N-(2,2-diethoxyethyl)-3-oxo-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Traditional Name: 5-benzyl-N-(2,2-diethoxyethyl)-3-keto-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Formula: C26H29N4O4+ MolecularWeight: 461.53286

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CNC(=O)C1=C2C(=C[N+](=C1)CC3=CC=CC=C3)C(=O)N(N2)C4=CC=CC=C4)OCC

Isomeric SMILES

CCOC(CNC(=O)C1=C2C(=C[N+](=C1)CC3=CC=CC=C3)C(=O)N(N2)C4=CC=CC=C4)OCC

InChI

InChI=1S/C26H28N4O4/c1-3-33-23(34-4-2)15-27-25(31)21-17-29(16-19-11-7-5-8-12-19)18-22-24(21)28-30(26(22)32)20-13-9-6-10-14-20/h5-14,17-18,23H,3-4,15-16H2,1-2H3,(H,27,31)/p+1