(2S,3S)-2-[4-(2-phenoxyethoxy)phenyl]-2,3-dihydro-1,4-benzodioxine-3-carboxylate

Systemtic Name: (2S,3S)-2-[4-(2-phenoxyethoxy)phenyl]-2,3-dihydro-1,4-benzodioxine-3-carboxylate Openeye Name: (2S,3S)-2-[4-(2-phenoxyethoxy)phenyl]-2,3-dihydro-1,4-benzodioxine-3-carboxylate CAS Name: (2S,3S)-2-[4-(2-phenoxyethoxy)phenyl]-2,3-dihydro-1,4-benzodioxin-3-carboxylate IUPAC Name: (2S,3S)-2-[4-(2-phenoxyethoxy)phenyl]-2,3-dihydro-1,4-benzodioxine-3-carboxylate Traditional Name: (2S,3S)-2-[4-(2-phenoxyethoxy)phenyl]-2,3-dihydro-1,4-benzodioxin-3-carboxylate Formula: C23H19O6- MolecularWeight: 391.39336

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCOC2=CC=C(C=C2)C3C(OC4=CC=CC=C4O3)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OCCOC2=CC=C(C=C2)[C@H]3[C@H](OC4=CC=CC=C4O3)C(=O)[O-]

InChI

InChI=1S/C23H20O6/c24-23(25)22-21(28-19-8-4-5-9-20(19)29-22)16-10-12-18(13-11-16)27-15-14-26-17-6-2-1-3-7-17/h1-13,21-22H,14-15H2,(H,24,25)/p-1/t21-,22-/m0/s1