2-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)guanidine sulfate

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)guanidine sulfate Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)guanidine sulfate CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)guanidine sulfate IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)guanidine sulfate Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)guanidine sulfate Formula: C10H13N3O6S-2 MolecularWeight: 303.29172

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)CN=C(N)N.[O-]S(=O)(=O)[O-]

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)CN=C(N)N.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C10H13N3O2.H2O4S/c11-10(12)13-6-7-1-2-8-9(5-7)15-4-3-14-8;1-5(2,3)4/h1-2,5H,3-4,6H2,(H4,11,12,13);(H2,1,2,3,4)/p-2