(E)-3-(5-bromanyl-2,4-dimethoxy-phenyl)-2-oxidanyl-1-[3-(2-oxidanylcyclohexyl)phenyl]prop-2-en-1-one

Systemtic Name: (E)-3-(5-bromanyl-2,4-dimethoxy-phenyl)-2-oxidanyl-1-[3-(2-oxidanylcyclohexyl)phenyl]prop-2-en-1-one Openeye Name: (E)-3-(5-bromo-2,4-dimethoxy-phenyl)-2-hydroxy-1-[3-(2-hydroxycyclohexyl)phenyl]prop-2-en-1-one CAS Name: (E)-3-(5-bromo-2,4-dimethoxyphenyl)-2-hydroxy-1-[3-(2-hydroxycyclohexyl)phenyl]-2-propen-1-one IUPAC Name: (E)-3-(5-bromo-2,4-dimethoxyphenyl)-2-hydroxy-1-[3-(2-hydroxycyclohexyl)phenyl]prop-2-en-1-one Traditional Name: (E)-3-(5-bromo-2,4-dimethoxy-phenyl)-2-hydroxy-1-[3-(2-hydroxycyclohexyl)phenyl]prop-2-en-1-one Formula: C23H25BrO5 MolecularWeight: 461.3456

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C=C(C(=O)C2=CC(=CC=C2)C3CCCCC3O)O)Br)OC

Isomeric SMILES

COC1=CC(=C(C=C1/C=C(\C(=O)C2=CC(=CC=C2)C3CCCCC3O)/O)Br)OC

InChI

InChI=1S/C23H25BrO5/c1-28-21-13-22(29-2)18(24)11-16(21)12-20(26)23(27)15-7-5-6-14(10-15)17-8-3-4-9-19(17)25/h5-7,10-13,17,19,25-26H,3-4,8-9H2,1-2H3/b20-12+