4-(2-bromanyl-3,4,5-trimethoxy-phenyl)butan-2-one

Systemtic Name: 4-(2-bromanyl-3,4,5-trimethoxy-phenyl)butan-2-one Openeye Name: 4-(2-bromo-3,4,5-trimethoxy-phenyl)butan-2-one CAS Name: 4-(2-bromo-3,4,5-trimethoxyphenyl)-2-butanone IUPAC Name: 4-(2-bromo-3,4,5-trimethoxyphenyl)butan-2-one Traditional Name: 4-(2-bromo-3,4,5-trimethoxy-phenyl)butan-2-one Formula: C13H17BrO4 MolecularWeight: 317.17568

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC1=CC(=C(C(=C1Br)OC)OC)OC

Isomeric SMILES

CC(=O)CCC1=CC(=C(C(=C1Br)OC)OC)OC

InChI

InChI=1S/C13H17BrO4/c1-8(15)5-6-9-7-10(16-2)12(17-3)13(18-4)11(9)14/h7H,5-6H2,1-4H3