[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(5-methoxycarbonylfuran-2-yl)methyl]-methyl-azanium

Systemtic Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(5-methoxycarbonylfuran-2-yl)methyl]-methyl-azanium Openeye Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(5-methoxycarbonyl-2-furyl)methyl]-methyl-ammonium CAS Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(5-methoxycarbonyl-2-furanyl)methyl]-methylammonium IUPAC Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(5-methoxycarbonylfuran-2-yl)methyl]-methylazanium Traditional Name: (5-carbomethoxy-2-furyl)methyl-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-methyl-ammonium Formula: C17H20NO5+ MolecularWeight: 318.3444

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1COC2=CC=CC=C2O1)CC3=CC=C(O3)C(=O)OC

Isomeric SMILES

C[NH+](C[C@H]1COC2=CC=CC=C2O1)CC3=CC=C(O3)C(=O)OC

InChI

InChI=1S/C17H19NO5/c1-18(9-12-7-8-16(22-12)17(19)20-2)10-13-11-21-14-5-3-4-6-15(14)23-13/h3-8,13H,9-11H2,1-2H3/p+1/t13-/m0/s1