methyl 4-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methoxy]benzoate

Systemtic Name: methyl 4-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methoxy]benzoate Openeye Name: methyl 4-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methoxy]benzoate CAS Name: 4-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methoxy]benzoate Traditional Name: 4-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methoxy]benzoic acid methyl ester Formula: C18H17ClO5 MolecularWeight: 348.77758

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17ClO5/c1-21-18(20)13-3-5-14(6-4-13)24-11-12-9-15(19)17-16(10-12)22-7-2-8-23-17/h3-6,9-10H,2,7-8,11H2,1H3