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

Systemtic Name: N-(4-ethoxyphenyl)-3-oxidanylidene-2-phenyl-5-(phenylmethyl)-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Openeye Name: 5-benzyl-N-(4-ethoxyphenyl)-3-oxo-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide CAS Name: N-(4-ethoxyphenyl)-3-oxo-2-phenyl-5-(phenylmethyl)-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide IUPAC Name: 5-benzyl-N-(4-ethoxyphenyl)-3-oxo-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Traditional Name: 5-benzyl-3-keto-2-phenyl-N-p-phenetyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Formula: C28H25N4O3+ MolecularWeight: 465.5231

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C2=C3C(=C[N+](=C2)CC4=CC=CC=C4)C(=O)N(N3)C5=CC=CC=C5

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C2=C3C(=C[N+](=C2)CC4=CC=CC=C4)C(=O)N(N3)C5=CC=CC=C5

InChI

InChI=1S/C28H24N4O3/c1-2-35-23-15-13-21(14-16-23)29-27(33)24-18-31(17-20-9-5-3-6-10-20)19-25-26(24)30-32(28(25)34)22-11-7-4-8-12-22/h3-16,18-19H,2,17H2,1H3,(H,29,33)/p+1