[azaniumylidene(azanyl)methyl]-[2-(1,3-benzodioxol-5-yl)ethyl]azanium sulfate

Systemtic Name: [azaniumylidene(azanyl)methyl]-[2-(1,3-benzodioxol-5-yl)ethyl]azanium sulfate Openeye Name: [amino(azaniumylidene)methyl]-[2-(1,3-benzodioxol-5-yl)ethyl]ammonium sulfate CAS Name: [amino(iminio)methyl]-[2-(1,3-benzodioxol-5-yl)ethyl]ammonium sulfate IUPAC Name: [amino(azaniumylidene)methyl]-[2-(1,3-benzodioxol-5-yl)ethyl]azanium sulfate Traditional Name: [amino(iminio)methyl]-homopiperonyl-ammonium sulfate Formula: C10H15N3O6S MolecularWeight: 305.3076

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CC[NH2+]C(=[NH2+])N.[O-]S(=O)(=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CC[NH2+]C(=[NH2+])N.[O-]S(=O)(=O)[O-]

InChI

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