[6-(1,3-benzodioxol-5-ylamino)-6-oxidanylidene-hexyl]azanium

Systemtic Name: [6-(1,3-benzodioxol-5-ylamino)-6-oxidanylidene-hexyl]azanium Openeye Name: [6-(1,3-benzodioxol-5-ylamino)-6-oxo-hexyl]ammonium CAS Name: [6-(1,3-benzodioxol-5-ylamino)-6-oxohexyl]ammonium IUPAC Name: [6-(1,3-benzodioxol-5-ylamino)-6-oxohexyl]azanium Traditional Name: [6-(1,3-benzodioxol-5-ylamino)-6-keto-hexyl]ammonium Formula: C13H19N2O3+ MolecularWeight: 251.30156

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)CCCCC[NH3+]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)CCCCC[NH3+]

InChI

InChI=1S/C13H18N2O3/c14-7-3-1-2-4-13(16)15-10-5-6-11-12(8-10)18-9-17-11/h5-6,8H,1-4,7,9,14H2,(H,15,16)/p+1