(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl 2,4-bis(oxidanyl)benzoate

Systemtic Name: (6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl 2,4-bis(oxidanyl)benzoate Openeye Name: (6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl 2,4-dihydroxybenzoate CAS Name: 2,4-dihydroxybenzoic acid (6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl ester IUPAC Name: (6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl 2,4-dihydroxybenzoate Traditional Name: 2,4-dihydroxybenzoic acid (6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl ester Formula: C17H15ClO6 MolecularWeight: 350.7504

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)COC(=O)C3=C(C=C(C=C3)O)O)Cl)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)COC(=O)C3=C(C=C(C=C3)O)O)Cl)OC1

InChI

InChI=1S/C17H15ClO6/c18-13-6-10(7-15-16(13)23-5-1-4-22-15)9-24-17(21)12-3-2-11(19)8-14(12)20/h2-3,6-8,19-20H,1,4-5,9H2