2-phenyl-5-propan-2-yl-7-[4-(pyridin-2-ylmethyl)piperazin-1-yl]carbonyl-1H-pyrazolo[4,3-c]pyridin-5-ium-3-one

Systemtic Name: 2-phenyl-5-propan-2-yl-7-[4-(pyridin-2-ylmethyl)piperazin-1-yl]carbonyl-1H-pyrazolo[4,3-c]pyridin-5-ium-3-one Openeye Name: 5-isopropyl-2-phenyl-7-[4-(2-pyridylmethyl)piperazine-1-carbonyl]-1H-pyrazolo[4,3-c]pyridin-5-ium-3-one CAS Name: 7-[oxo-[4-(2-pyridinylmethyl)-1-piperazinyl]methyl]-2-phenyl-5-propan-2-yl-1H-pyrazolo[4,3-c]pyridin-5-ium-3-one IUPAC Name: 2-phenyl-5-propan-2-yl-7-[4-(pyridin-2-ylmethyl)piperazine-1-carbonyl]-1H-pyrazolo[4,3-c]pyridin-5-ium-3-one Traditional Name: 5-isopropyl-2-phenyl-7-[4-(2-pyridylmethyl)piperazine-1-carbonyl]-1H-pyrazolo[4,3-c]pyridin-5-ium-3-one Formula: C26H29N6O2+ MolecularWeight: 457.54746

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[N+]1=CC(=C2C(=C1)C(=O)N(N2)C3=CC=CC=C3)C(=O)N4CCN(CC4)CC5=CC=CC=N5

Isomeric SMILES

CC(C)[N+]1=CC(=C2C(=C1)C(=O)N(N2)C3=CC=CC=C3)C(=O)N4CCN(CC4)CC5=CC=CC=N5

InChI

InChI=1S/C26H28N6O2/c1-19(2)31-17-22(24-23(18-31)26(34)32(28-24)21-9-4-3-5-10-21)25(33)30-14-12-29(13-15-30)16-20-8-6-7-11-27-20/h3-11,17-19H,12-16H2,1-2H3/p+1