dimethyl 5-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methoxy]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methoxy]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methoxy]benzene-1,3-dicarboxylate CAS Name: 5-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methoxy]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methoxy]benzene-1,3-dicarboxylate Traditional Name: 5-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methoxy]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C20H19ClO7 MolecularWeight: 406.81366

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)OCC2=CC3=C(C(=C2)Cl)OCCCO3)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)OCC2=CC3=C(C(=C2)Cl)OCCCO3)C(=O)OC

InChI

InChI=1S/C20H19ClO7/c1-24-19(22)13-8-14(20(23)25-2)10-15(9-13)28-11-12-6-16(21)18-17(7-12)26-4-3-5-27-18/h6-10H,3-5,11H2,1-2H3