(2-bromanyl-4-chloranyl-phenyl) 3-(1,3-benzodioxol-5-yl)propanoate

Systemtic Name: (2-bromanyl-4-chloranyl-phenyl) 3-(1,3-benzodioxol-5-yl)propanoate Openeye Name: (2-bromo-4-chloro-phenyl) 3-(1,3-benzodioxol-5-yl)propanoate CAS Name: 3-(1,3-benzodioxol-5-yl)propanoic acid (2-bromo-4-chlorophenyl) ester IUPAC Name: (2-bromo-4-chlorophenyl) 3-(1,3-benzodioxol-5-yl)propanoate Traditional Name: 3-(1,3-benzodioxol-5-yl)propionic acid (2-bromo-4-chloro-phenyl) ester Formula: C16H12BrClO4 MolecularWeight: 383.62108

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CCC(=O)OC3=C(C=C(C=C3)Cl)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CCC(=O)OC3=C(C=C(C=C3)Cl)Br

InChI

InChI=1S/C16H12BrClO4/c17-12-8-11(18)3-5-13(12)22-16(19)6-2-10-1-4-14-15(7-10)21-9-20-14/h1,3-5,7-8H,2,6,9H2