(3,5-dimethoxyphenyl)methyl-[(3S)-2-oxidanylideneoxolan-3-yl]azanium

Systemtic Name: (3,5-dimethoxyphenyl)methyl-[(3S)-2-oxidanylideneoxolan-3-yl]azanium Openeye Name: (3,5-dimethoxyphenyl)methyl-[(3S)-2-oxotetrahydrofuran-3-yl]ammonium CAS Name: (3,5-dimethoxyphenyl)methyl-[(3S)-2-oxo-3-oxolanyl]ammonium IUPAC Name: (3,5-dimethoxyphenyl)methyl-[(3S)-2-oxooxolan-3-yl]azanium Traditional Name: (3,5-dimethoxybenzyl)-[(3S)-2-ketotetrahydrofuran-3-yl]ammonium Formula: C13H18NO4+ MolecularWeight: 252.28632

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C[NH2+]C2CCOC2=O)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C[NH2+][C@H]2CCOC2=O)OC

InChI

InChI=1S/C13H17NO4/c1-16-10-5-9(6-11(7-10)17-2)8-14-12-3-4-18-13(12)15/h5-7,12,14H,3-4,8H2,1-2H3/p+1/t12-/m0/s1