N-(2-morpholin-4-ium-4-ylethyl)-1-(phenylmethyl)pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: N-(2-morpholin-4-ium-4-ylethyl)-1-(phenylmethyl)pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 1-benzyl-N-(2-morpholin-4-ium-4-ylethyl)pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: N-[2-(4-morpholin-4-iumyl)ethyl]-1-(phenylmethyl)-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 1-benzyl-N-(2-morpholin-4-ium-4-ylethyl)pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: (1-benzylpyrazolo[3,4-d]pyrimidin-4-yl)-(2-morpholin-4-ium-4-ylethyl)amine Formula: C18H23N6O+ MolecularWeight: 339.41482

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC2=NC=NC3=C2C=NN3CC4=CC=CC=C4

Isomeric SMILES

C1COCC[NH+]1CCNC2=NC=NC3=C2C=NN3CC4=CC=CC=C4

InChI

InChI=1S/C18H22N6O/c1-2-4-15(5-3-1)13-24-18-16(12-22-24)17(20-14-21-18)19-6-7-23-8-10-25-11-9-23/h1-5,12,14H,6-11,13H2,(H,19,20,21)/p+1