(E)-1-(4-bromophenyl)-7-(4-methoxy-3-oxidanyl-phenyl)hept-6-en-3-one

Systemtic Name: (E)-1-(4-bromophenyl)-7-(4-methoxy-3-oxidanyl-phenyl)hept-6-en-3-one Openeye Name: (E)-1-(4-bromophenyl)-7-(3-hydroxy-4-methoxy-phenyl)hept-6-en-3-one CAS Name: (E)-1-(4-bromophenyl)-7-(3-hydroxy-4-methoxyphenyl)-6-hepten-3-one IUPAC Name: (E)-1-(4-bromophenyl)-7-(3-hydroxy-4-methoxyphenyl)hept-6-en-3-one Traditional Name: (E)-1-(4-bromophenyl)-7-(3-hydroxy-4-methoxy-phenyl)hept-6-en-3-one Formula: C20H21BrO3 MolecularWeight: 389.28294

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CCCC(=O)CCC2=CC=C(C=C2)Br)O

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/CCC(=O)CCC2=CC=C(C=C2)Br)O

InChI

InChI=1S/C20H21BrO3/c1-24-20-13-9-16(14-19(20)23)4-2-3-5-18(22)12-8-15-6-10-17(21)11-7-15/h2,4,6-7,9-11,13-14,23H,3,5,8,12H2,1H3/b4-2+