7-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-2-phenyl-5-propyl-1H-pyrazolo[4,3-c]pyridin-5-ium-3-one

Systemtic Name: 7-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-2-phenyl-5-propyl-1H-pyrazolo[4,3-c]pyridin-5-ium-3-one Openeye Name: 7-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2-phenyl-5-propyl-1H-pyrazolo[4,3-c]pyridin-5-ium-3-one CAS Name: 7-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-2-phenyl-5-propyl-1H-pyrazolo[4,3-c]pyridin-5-ium-3-one IUPAC Name: 7-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2-phenyl-5-propyl-1H-pyrazolo[4,3-c]pyridin-5-ium-3-one Traditional Name: 7-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2-phenyl-5-propyl-1H-pyrazolo[4,3-c]pyridin-5-ium-3-one Formula: C25H25N4O2+ MolecularWeight: 413.4916

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+]1=CC(=C2C(=C1)C(=O)N(N2)C3=CC=CC=C3)C(=O)N4CCC5=CC=CC=C5C4

Isomeric SMILES

CCC[N+]1=CC(=C2C(=C1)C(=O)N(N2)C3=CC=CC=C3)C(=O)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C25H24N4O2/c1-2-13-27-16-21(24(30)28-14-12-18-8-6-7-9-19(18)15-28)23-22(17-27)25(31)29(26-23)20-10-4-3-5-11-20/h3-11,16-17H,2,12-15H2,1H3/p+1