[(3S)-6-oxidanyl-2,3-dihydro-1-benzofuran-3-yl]-[[(2R)-oxolan-2-yl]methyl]azanium

Systemtic Name: [(3S)-6-oxidanyl-2,3-dihydro-1-benzofuran-3-yl]-[[(2R)-oxolan-2-yl]methyl]azanium Openeye Name: [(3S)-6-hydroxy-2,3-dihydrobenzofuran-3-yl]-[[(2R)-tetrahydrofuran-2-yl]methyl]ammonium CAS Name: [(3S)-6-hydroxy-2,3-dihydrobenzofuran-3-yl]-[[(2R)-2-oxolanyl]methyl]ammonium IUPAC Name: [(3S)-6-hydroxy-2,3-dihydro-1-benzofuran-3-yl]-[[(2R)-oxolan-2-yl]methyl]azanium Traditional Name: [(3S)-6-hydroxycoumaran-3-yl]-[[(2R)-tetrahydrofuran-2-yl]methyl]ammonium Formula: C13H18NO3+ MolecularWeight: 236.28692

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)C[NH2+]C2COC3=C2C=CC(=C3)O

Isomeric SMILES

C1C[C@@H](OC1)C[NH2+][C@@H]2COC3=C2C=CC(=C3)O

InChI

InChI=1S/C13H17NO3/c15-9-3-4-11-12(8-17-13(11)6-9)14-7-10-2-1-5-16-10/h3-4,6,10,12,14-15H,1-2,5,7-8H2/p+1/t10-,12-/m1/s1