3-(1,3-benzodioxol-5-yl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine-1-carboximidamide

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine-1-carboximidamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine-1-carboxamidine CAS Name: 3-(1,3-benzodioxol-5-yl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine-1-carboximidamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine-1-carboximidamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-4,5,6,7-tetrahydro-2H-pyrazol[3,4-b]azepine-1-carboxamidine Formula: C15H17N5O2 MolecularWeight: 299.32778

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN=C2C(=C(NN2C(=N)N)C3=CC4=C(C=C3)OCO4)C1

Isomeric SMILES

C1CCN=C2C(=C(NN2C(=N)N)C3=CC4=C(C=C3)OCO4)C1

InChI

InChI=1S/C15H17N5O2/c16-15(17)20-14-10(3-1-2-6-18-14)13(19-20)9-4-5-11-12(7-9)22-8-21-11/h4-5,7,19H,1-3,6,8H2,(H3,16,17)