[8-[(6-azaniumyl-4H-1,3-benzodioxin-8-yl)methyl]-4H-1,3-benzodioxin-6-yl]azanium

Systemtic Name: [8-[(6-azaniumyl-4H-1,3-benzodioxin-8-yl)methyl]-4H-1,3-benzodioxin-6-yl]azanium Openeye Name: [8-[(6-azaniumyl-4H-1,3-benzodioxin-8-yl)methyl]-4H-1,3-benzodioxin-6-yl]ammonium CAS Name: [8-[(6-ammonio-4H-1,3-benzodioxin-8-yl)methyl]-4H-1,3-benzodioxin-6-yl]ammonium IUPAC Name: [8-[(6-azaniumyl-4H-1,3-benzodioxin-8-yl)methyl]-4H-1,3-benzodioxin-6-yl]azanium Traditional Name: [8-[(6-ammonio-4H-1,3-benzodioxin-8-yl)methyl]-4H-1,3-benzodioxin-6-yl]ammonium Formula: C17H20N2O4+2 MolecularWeight: 316.3517

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)CC3=C4C(=CC(=C3)[NH3+])COCO4)[NH3+]

Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)CC3=C4C(=CC(=C3)[NH3+])COCO4)[NH3+]

InChI

InChI=1S/C17H18N2O4/c18-14-2-10(16-12(4-14)6-20-8-22-16)1-11-3-15(19)5-13-7-21-9-23-17(11)13/h2-5H,1,6-9,18-19H2/p+2