3,4-dimethyl-7-(2-morpholin-4-ium-4-ylethyl)-1-phenyl-pyrazolo[3,4-b]pyridin-6-one

Systemtic Name: 3,4-dimethyl-7-(2-morpholin-4-ium-4-ylethyl)-1-phenyl-pyrazolo[3,4-b]pyridin-6-one Openeye Name: 3,4-dimethyl-7-(2-morpholin-4-ium-4-ylethyl)-1-phenyl-pyrazolo[3,4-b]pyridin-6-one CAS Name: 3,4-dimethyl-7-[2-(4-morpholin-4-iumyl)ethyl]-1-phenyl-6-pyrazolo[3,4-b]pyridinone IUPAC Name: 3,4-dimethyl-7-(2-morpholin-4-ium-4-ylethyl)-1-phenylpyrazolo[3,4-b]pyridin-6-one Traditional Name: 3,4-dimethyl-7-(2-morpholin-4-ium-4-ylethyl)-1-phenyl-pyrazolo[3,4-b]pyridin-6-one Formula: C20H25N4O2+ MolecularWeight: 353.4381

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C2=C1C(=NN2C3=CC=CC=C3)C)CC[NH+]4CCOCC4

Isomeric SMILES

CC1=CC(=O)N(C2=C1C(=NN2C3=CC=CC=C3)C)CC[NH+]4CCOCC4

InChI

InChI=1S/C20H24N4O2/c1-15-14-18(25)23(9-8-22-10-12-26-13-11-22)20-19(15)16(2)21-24(20)17-6-4-3-5-7-17/h3-7,14H,8-13H2,1-2H3/p+1