(1-ethyl-3,6-dimethyl-pyrazolo[3,4-b]pyridin-4-yl)-(4-propylpiperazin-4-ium-1-yl)methanone

Systemtic Name: (1-ethyl-3,6-dimethyl-pyrazolo[3,4-b]pyridin-4-yl)-(4-propylpiperazin-4-ium-1-yl)methanone Openeye Name: (1-ethyl-3,6-dimethyl-pyrazolo[3,4-b]pyridin-4-yl)-(4-propylpiperazin-4-ium-1-yl)methanone CAS Name: (1-ethyl-3,6-dimethyl-4-pyrazolo[3,4-b]pyridinyl)-(4-propyl-1-piperazin-4-iumyl)methanone IUPAC Name: (1-ethyl-3,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)-(4-propylpiperazin-4-ium-1-yl)methanone Traditional Name: (1-ethyl-3,6-dimethyl-pyrazolo[3,4-b]pyridin-4-yl)-(4-propylpiperazin-4-ium-1-yl)methanone Formula: C18H28N5O+ MolecularWeight: 330.44782

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCN(CC1)C(=O)C2=CC(=NC3=C2C(=NN3CC)C)C

Isomeric SMILES

CCC[NH+]1CCN(CC1)C(=O)C2=CC(=NC3=C2C(=NN3CC)C)C

InChI

InChI=1S/C18H27N5O/c1-5-7-21-8-10-22(11-9-21)18(24)15-12-13(3)19-17-16(15)14(4)20-23(17)6-2/h12H,5-11H2,1-4H3/p+1