[3-azaniumyl-2-(1,3-benzodioxol-5-yl)-6-methoxy-oxan-3-yl]methylazanium

Systemtic Name: [3-azaniumyl-2-(1,3-benzodioxol-5-yl)-6-methoxy-oxan-3-yl]methylazanium Openeye Name: [3-azaniumyl-2-(1,3-benzodioxol-5-yl)-6-methoxy-tetrahydropyran-3-yl]methylammonium CAS Name: [3-ammonio-2-(1,3-benzodioxol-5-yl)-6-methoxy-3-oxanyl]methylammonium IUPAC Name: [3-azaniumyl-2-(1,3-benzodioxol-5-yl)-6-methoxyoxan-3-yl]methylazanium Traditional Name: [3-ammonio-2-(1,3-benzodioxol-5-yl)-6-methoxy-tetrahydropyran-3-yl]methylammonium Formula: C14H22N2O4+2 MolecularWeight: 282.33548

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Descriptors Computed from Structure

Canonical SMILES:

COC1CCC(C(O1)C2=CC3=C(C=C2)OCO3)(C[NH3+])[NH3+]

Isomeric SMILES

COC1CCC(C(O1)C2=CC3=C(C=C2)OCO3)(C[NH3+])[NH3+]

InChI

InChI=1S/C14H20N2O4/c1-17-12-4-5-14(16,7-15)13(20-12)9-2-3-10-11(6-9)19-8-18-10/h2-3,6,12-13H,4-5,7-8,15-16H2,1H3/p+2