2-[[4-chloranyl-1-(3-methoxyphenyl)-3-methyl-pyrazolo[3,4-b]pyridin-5-yl]carbonylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[4-chloranyl-1-(3-methoxyphenyl)-3-methyl-pyrazolo[3,4-b]pyridin-5-yl]carbonylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[4-chloro-1-(3-methoxyphenyl)-3-methyl-pyrazolo[3,4-b]pyridine-5-carbonyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[[4-chloro-1-(3-methoxyphenyl)-3-methyl-5-pyrazolo[3,4-b]pyridinyl]-oxomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[4-chloro-1-(3-methoxyphenyl)-3-methylpyrazolo[3,4-b]pyridine-5-carbonyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[4-chloro-1-(3-methoxyphenyl)-3-methyl-pyrazolo[3,4-b]pyridine-5-carbonyl]amino]ethyl-dimethyl-ammonium Formula: C19H23ClN5O2+ MolecularWeight: 388.87122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=NC=C(C(=C12)Cl)C(=O)NCC[NH+](C)C)C3=CC(=CC=C3)OC

Isomeric SMILES

CC1=NN(C2=NC=C(C(=C12)Cl)C(=O)NCC[NH+](C)C)C3=CC(=CC=C3)OC

InChI

InChI=1S/C19H22ClN5O2/c1-12-16-17(20)15(19(26)21-8-9-24(2)3)11-22-18(16)25(23-12)13-6-5-7-14(10-13)27-4/h5-7,10-11H,8-9H2,1-4H3,(H,21,26)/p+1