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

Systemtic Name: N-[(4-methylphenyl)methyl]-3-oxidanylidene-2-phenyl-5-(phenylmethyl)-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Openeye Name: 5-benzyl-3-oxo-2-phenyl-N-(p-tolylmethyl)-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide CAS Name: N-[(4-methylphenyl)methyl]-3-oxo-2-phenyl-5-(phenylmethyl)-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide IUPAC Name: 5-benzyl-N-[(4-methylphenyl)methyl]-3-oxo-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Traditional Name: 5-benzyl-3-keto-N-(4-methylbenzyl)-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Formula: C28H25N4O2+ MolecularWeight: 449.5237

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2=C3C(=C[N+](=C2)CC4=CC=CC=C4)C(=O)N(N3)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2=C3C(=C[N+](=C2)CC4=CC=CC=C4)C(=O)N(N3)C5=CC=CC=C5

InChI

InChI=1S/C28H24N4O2/c1-20-12-14-21(15-13-20)16-29-27(33)24-18-31(17-22-8-4-2-5-9-22)19-25-26(24)30-32(28(25)34)23-10-6-3-7-11-23/h2-15,18-19H,16-17H2,1H3,(H,29,33)/p+1