5-[(Z)-1,3-benzodioxol-5-ylmethylideneamino]-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-ium-4-amine

Systemtic Name: 5-[(Z)-1,3-benzodioxol-5-ylmethylideneamino]-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-ium-4-amine Openeye Name: 5-[(Z)-1,3-benzodioxol-5-ylmethyleneamino]-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-ium-4-amine CAS Name: 5-[(Z)-1,3-benzodioxol-5-ylmethylideneamino]-1-phenyl-4-pyrazolo[3,4-d]pyrimidin-5-iumamine IUPAC Name: 5-[(Z)-1,3-benzodioxol-5-ylmethylideneamino]-1-phenylpyrazolo[3,4-d]pyrimidin-5-ium-4-amine Traditional Name: [1-phenyl-5-[(Z)-piperonylideneamino]pyrazolo[3,4-d]pyrimidin-5-ium-4-yl]amine Formula: C19H15N6O2+ MolecularWeight: 359.3614

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=N[N+]3=C(C4=C(N=C3)N(N=C4)C5=CC=CC=C5)N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=N\[N+]3=C(C4=C(N=C3)N(N=C4)C5=CC=CC=C5)N

InChI

InChI=1S/C19H14N6O2/c20-18-15-10-23-25(14-4-2-1-3-5-14)19(15)21-11-24(18)22-9-13-6-7-16-17(8-13)27-12-26-16/h1-11,20H,12H2/p+1/b22-9-