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

Systemtic Name: (6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl benzoate Openeye Name: (6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl benzoate CAS Name: benzoic 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 benzoate Traditional Name: benzoic acid (6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl ester Formula: C17H15ClO4 MolecularWeight: 318.7516

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15ClO4/c18-14-9-12(10-15-16(14)21-8-4-7-20-15)11-22-17(19)13-5-2-1-3-6-13/h1-3,5-6,9-10H,4,7-8,11H2