[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxidanylidene-ethyl] 4-bromanyl-3-methyl-benzoate

Systemtic Name: [2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxidanylidene-ethyl] 4-bromanyl-3-methyl-benzoate Openeye Name: [2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxo-ethyl] 4-bromo-3-methyl-benzoate CAS Name: 4-bromo-3-methylbenzoic acid [2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl] ester IUPAC Name: [2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl] 4-bromo-3-methylbenzoate Traditional Name: 4-bromo-3-methyl-benzoic acid [2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-keto-ethyl] ester Formula: C18H15BrO5 MolecularWeight: 391.2127

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)OCC(=O)C2=CC3=C(C=C2)OCCO3)Br

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)OCC(=O)C2=CC3=C(C=C2)OCCO3)Br

InChI

InChI=1S/C18H15BrO5/c1-11-8-13(2-4-14(11)19)18(21)24-10-15(20)12-3-5-16-17(9-12)23-7-6-22-16/h2-5,8-9H,6-7,10H2,1H3