[4-(4-bromophenyl)-4-oxidanylidene-butyl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate

Systemtic Name: [4-(4-bromophenyl)-4-oxidanylidene-butyl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate Openeye Name: [4-(4-bromophenyl)-4-oxo-butyl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate CAS Name: 2,3-dihydro-1,4-benzodioxin-6-carboxylic acid [4-(4-bromophenyl)-4-oxobutyl] ester IUPAC Name: [4-(4-bromophenyl)-4-oxobutyl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-carboxylic acid [4-(4-bromophenyl)-4-keto-butyl] ester Formula: C19H17BrO5 MolecularWeight: 405.23928

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C(=O)OCCCC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C(=O)OCCCC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C19H17BrO5/c20-15-6-3-13(4-7-15)16(21)2-1-9-25-19(22)14-5-8-17-18(12-14)24-11-10-23-17/h3-8,12H,1-2,9-11H2