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

Systemtic Name: N-(4-butylphenyl)-3-oxidanylidene-2-phenyl-5-(phenylmethyl)-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Openeye Name: 5-benzyl-N-(4-butylphenyl)-3-oxo-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide CAS Name: N-(4-butylphenyl)-3-oxo-2-phenyl-5-(phenylmethyl)-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide IUPAC Name: 5-benzyl-N-(4-butylphenyl)-3-oxo-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Traditional Name: 5-benzyl-N-(4-butylphenyl)-3-keto-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Formula: C30H29N4O2+ MolecularWeight: 477.57686

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=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

CCCCC1=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/C30H28N4O2/c1-2-3-10-22-15-17-24(18-16-22)31-29(35)26-20-33(19-23-11-6-4-7-12-23)21-27-28(26)32-34(30(27)36)25-13-8-5-9-14-25/h4-9,11-18,20-21H,2-3,10,19H2,1H3,(H,31,35)/p+1