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

Systemtic Name: 3-oxidanylidene-2-phenyl-5-(phenylmethyl)-N-(4-propan-2-ylphenyl)-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Openeye Name: 5-benzyl-N-(4-isopropylphenyl)-3-oxo-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide CAS Name: 3-oxo-2-phenyl-5-(phenylmethyl)-N-(4-propan-2-ylphenyl)-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide IUPAC Name: 5-benzyl-3-oxo-2-phenyl-N-(4-propan-2-ylphenyl)-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Traditional Name: 5-benzyl-3-keto-N-p-cumenyl-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Formula: C29H27N4O2+ MolecularWeight: 463.55028

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=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

CC(C)C1=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/C29H26N4O2/c1-20(2)22-13-15-23(16-14-22)30-28(34)25-18-32(17-21-9-5-3-6-10-21)19-26-27(25)31-33(29(26)35)24-11-7-4-8-12-24/h3-16,18-20H,17H2,1-2H3,(H,30,34)/p+1