(7-methyl-3,4-dihydro-2H-1,5-benzodioxepin-3-yl) benzoate

Systemtic Name: (7-methyl-3,4-dihydro-2H-1,5-benzodioxepin-3-yl) benzoate Openeye Name: (7-methyl-3,4-dihydro-2H-1,5-benzodioxepin-3-yl) benzoate CAS Name: benzoic acid (7-methyl-3,4-dihydro-2H-1,5-benzodioxepin-3-yl) ester IUPAC Name: (7-methyl-3,4-dihydro-2H-1,5-benzodioxepin-3-yl) benzoate Traditional Name: benzoic acid (7-methyl-3,4-dihydro-2H-1,5-benzodioxepin-3-yl) ester Formula: C17H16O4 MolecularWeight: 284.30654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OCC(CO2)OC(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC2=C(C=C1)OCC(CO2)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H16O4/c1-12-7-8-15-16(9-12)20-11-14(10-19-15)21-17(18)13-5-3-2-4-6-13/h2-9,14H,10-11H2,1H3