8-(pyrazol-1-ylmethyl)-4H-1,3-benzodioxin-6-amine

Systemtic Name: 8-(pyrazol-1-ylmethyl)-4H-1,3-benzodioxin-6-amine Openeye Name: 8-(pyrazol-1-ylmethyl)-4H-1,3-benzodioxin-6-amine CAS Name: 8-(1-pyrazolylmethyl)-4H-1,3-benzodioxin-6-amine IUPAC Name: 8-(pyrazol-1-ylmethyl)-4H-1,3-benzodioxin-6-amine Traditional Name: [8-(pyrazol-1-ylmethyl)-4H-1,3-benzodioxin-6-yl]amine Formula: C12H13N3O2 MolecularWeight: 231.25052

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)CN3C=CC=N3)N

Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)CN3C=CC=N3)N

InChI

InChI=1S/C12H13N3O2/c13-11-4-9(6-15-3-1-2-14-15)12-10(5-11)7-16-8-17-12/h1-5H,6-8,13H2