2-phenyl-5-propyl-7-pyrrolidin-1-ylcarbonyl-1H-pyrazolo[4,3-c]pyridin-5-ium-3-one

Systemtic Name: 2-phenyl-5-propyl-7-pyrrolidin-1-ylcarbonyl-1H-pyrazolo[4,3-c]pyridin-5-ium-3-one Openeye Name: 2-phenyl-5-propyl-7-(pyrrolidine-1-carbonyl)-1H-pyrazolo[4,3-c]pyridin-5-ium-3-one CAS Name: 7-[oxo(1-pyrrolidinyl)methyl]-2-phenyl-5-propyl-1H-pyrazolo[4,3-c]pyridin-5-ium-3-one IUPAC Name: 2-phenyl-5-propyl-7-(pyrrolidine-1-carbonyl)-1H-pyrazolo[4,3-c]pyridin-5-ium-3-one Traditional Name: 2-phenyl-5-propyl-7-(pyrrolidine-1-carbonyl)-1H-pyrazolo[4,3-c]pyridin-5-ium-3-one Formula: C20H23N4O2+ MolecularWeight: 351.42222

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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)N4CCCC4

Isomeric SMILES

CCC[N+]1=CC(=C2C(=C1)C(=O)N(N2)C3=CC=CC=C3)C(=O)N4CCCC4

InChI

InChI=1S/C20H22N4O2/c1-2-10-22-13-16(19(25)23-11-6-7-12-23)18-17(14-22)20(26)24(21-18)15-8-4-3-5-9-15/h3-5,8-9,13-14H,2,6-7,10-12H2,1H3/p+1