(2S,3S)-2-(hydroxymethyl)-3-(3-methoxy-4-oxidanyl-phenyl)-2,3-dihydro-1,4-benzodioxine-6-carbaldehyde

Systemtic Name: (2S,3S)-2-(hydroxymethyl)-3-(3-methoxy-4-oxidanyl-phenyl)-2,3-dihydro-1,4-benzodioxine-6-carbaldehyde Openeye Name: (2S,3S)-3-(4-hydroxy-3-methoxy-phenyl)-2-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxine-6-carbaldehyde CAS Name: (2S,3S)-3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxin-6-carboxaldehyde IUPAC Name: (2S,3S)-3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxine-6-carbaldehyde Traditional Name: (2S,3S)-3-(4-hydroxy-3-methoxy-phenyl)-2-methylol-2,3-dihydro-1,4-benzodioxin-6-carbaldehyde Formula: C17H16O6 MolecularWeight: 316.30534

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2C(OC3=C(O2)C=C(C=C3)C=O)CO)O

Isomeric SMILES

COC1=C(C=CC(=C1)[C@H]2[C@@H](OC3=C(O2)C=C(C=C3)C=O)CO)O

InChI

InChI=1S/C17H16O6/c1-21-14-7-11(3-4-12(14)20)17-16(9-19)22-13-5-2-10(8-18)6-15(13)23-17/h2-8,16-17,19-20H,9H2,1H3/t16-,17-/m0/s1