(3-ethoxy-4-oxidanyl-phenyl)methyl-[(3S)-2-oxidanylideneoxolan-3-yl]azanium

Systemtic Name: (3-ethoxy-4-oxidanyl-phenyl)methyl-[(3S)-2-oxidanylideneoxolan-3-yl]azanium Openeye Name: (3-ethoxy-4-hydroxy-phenyl)methyl-[(3S)-2-oxotetrahydrofuran-3-yl]ammonium CAS Name: (3-ethoxy-4-hydroxyphenyl)methyl-[(3S)-2-oxo-3-oxolanyl]ammonium IUPAC Name: (3-ethoxy-4-hydroxyphenyl)methyl-[(3S)-2-oxooxolan-3-yl]azanium Traditional Name: (3-ethoxy-4-hydroxy-benzyl)-[(3S)-2-ketotetrahydrofuran-3-yl]ammonium Formula: C13H18NO4+ MolecularWeight: 252.28632

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C[NH2+]C2CCOC2=O)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)C[NH2+][C@H]2CCOC2=O)O

InChI

InChI=1S/C13H17NO4/c1-2-17-12-7-9(3-4-11(12)15)8-14-10-5-6-18-13(10)16/h3-4,7,10,14-15H,2,5-6,8H2,1H3/p+1/t10-/m0/s1