2,3-dimethoxy-6-[(2S)-4-oxidanylidene-2,3-dihydrochromen-2-yl]benzoate

Systemtic Name: 2,3-dimethoxy-6-[(2S)-4-oxidanylidene-2,3-dihydrochromen-2-yl]benzoate Openeye Name: 2,3-dimethoxy-6-[(2S)-4-oxochroman-2-yl]benzoate CAS Name: 2,3-dimethoxy-6-[(2S)-4-oxo-3,4-dihydro-2H-1-benzopyran-2-yl]benzoate IUPAC Name: 2,3-dimethoxy-6-[(2S)-4-oxo-2,3-dihydrochromen-2-yl]benzoate Traditional Name: 6-[(2S)-4-ketochroman-2-yl]-2,3-dimethoxy-benzoate Formula: C18H15O6- MolecularWeight: 327.3081

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C2CC(=O)C3=CC=CC=C3O2)C(=O)[O-])OC

Isomeric SMILES

COC1=C(C(=C(C=C1)[C@@H]2CC(=O)C3=CC=CC=C3O2)C(=O)[O-])OC

InChI

InChI=1S/C18H16O6/c1-22-14-8-7-11(16(18(20)21)17(14)23-2)15-9-12(19)10-5-3-4-6-13(10)24-15/h3-8,15H,9H2,1-2H3,(H,20,21)/p-1/t15-/m0/s1