methyl 7-bromanyl-4-chloranyl-2,2-diphenyl-1,3-benzodioxole-5-carboxylate

Systemtic Name: methyl 7-bromanyl-4-chloranyl-2,2-diphenyl-1,3-benzodioxole-5-carboxylate Openeye Name: methyl 7-bromo-4-chloro-2,2-diphenyl-1,3-benzodioxole-5-carboxylate CAS Name: 7-bromo-4-chloro-2,2-diphenyl-1,3-benzodioxole-5-carboxylic acid methyl ester IUPAC Name: methyl 7-bromo-4-chloro-2,2-diphenyl-1,3-benzodioxole-5-carboxylate Traditional Name: 7-bromo-4-chloro-2,2-diphenyl-piperonylic acid methyl ester Formula: C21H14BrClO4 MolecularWeight: 445.69046

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C2C(=C1Cl)OC(O2)(C3=CC=CC=C3)C4=CC=CC=C4)Br

Isomeric SMILES

COC(=O)C1=CC(=C2C(=C1Cl)OC(O2)(C3=CC=CC=C3)C4=CC=CC=C4)Br

InChI

InChI=1S/C21H14BrClO4/c1-25-20(24)15-12-16(22)18-19(17(15)23)27-21(26-18,13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-12H,1H3