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

Systemtic Name: 3-oxidanylidene-2-phenyl-5-(phenylmethyl)-N-(3-propan-2-yloxypropyl)-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Openeye Name: 5-benzyl-N-(3-isopropoxypropyl)-3-oxo-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide CAS Name: 3-oxo-2-phenyl-5-(phenylmethyl)-N-(3-propan-2-yloxypropyl)-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide IUPAC Name: 5-benzyl-3-oxo-2-phenyl-N-(3-propan-2-yloxypropyl)-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Traditional Name: 5-benzyl-N-(3-isopropoxypropyl)-3-keto-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Formula: C26H29N4O3+ MolecularWeight: 445.53346

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H28N4O3/c1-19(2)33-15-9-14-27-25(31)22-17-29(16-20-10-5-3-6-11-20)18-23-24(22)28-30(26(23)32)21-12-7-4-8-13-21/h3-8,10-13,17-19H,9,14-16H2,1-2H3,(H,27,31)/p+1