(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxylate

Systemtic Name: (7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxylate Openeye Name: (7-hydroxy-2-oxo-chromen-4-yl)methyl 6-chloro-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxylate CAS Name: 6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxylic acid (7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-hydroxy-2-oxochromen-4-yl)methyl 6-chloro-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxylate Traditional Name: 6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxylic acid (7-hydroxy-2-keto-chromen-4-yl)methyl ester Formula: C20H15ClO7 MolecularWeight: 402.7819

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)C(=O)OCC3=CC(=O)OC4=C3C=CC(=C4)O)Cl)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)C(=O)OCC3=CC(=O)OC4=C3C=CC(=C4)O)Cl)OC1

InChI

InChI=1S/C20H15ClO7/c21-15-6-11(7-17-19(15)26-5-1-4-25-17)20(24)27-10-12-8-18(23)28-16-9-13(22)2-3-14(12)16/h2-3,6-9,22H,1,4-5,10H2