2-[(3-bromophenyl)-(2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl)methyl]-3-oxidanyl-cyclohex-2-en-1-one

Systemtic Name: 2-[(3-bromophenyl)-(2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl)methyl]-3-oxidanyl-cyclohex-2-en-1-one Openeye Name: 2-[(3-bromophenyl)-(2-hydroxy-6-oxo-cyclohexen-1-yl)methyl]-3-hydroxy-cyclohex-2-en-1-one CAS Name: 2-[(3-bromophenyl)-(2-hydroxy-6-oxo-1-cyclohexenyl)methyl]-3-hydroxy-1-cyclohex-2-enone IUPAC Name: 2-[(3-bromophenyl)-(2-hydroxy-6-oxocyclohexen-1-yl)methyl]-3-hydroxycyclohex-2-en-1-one Traditional Name: 2-[(3-bromophenyl)-(2-hydroxy-6-keto-cyclohexen-1-yl)methyl]-3-hydroxy-cyclohex-2-en-1-one Formula: C19H19BrO4 MolecularWeight: 391.25576

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=C(C(=O)C1)C(C2=CC(=CC=C2)Br)C3=C(CCCC3=O)O)O

Isomeric SMILES

C1CC(=C(C(=O)C1)C(C2=CC(=CC=C2)Br)C3=C(CCCC3=O)O)O

InChI

InChI=1S/C19H19BrO4/c20-12-5-1-4-11(10-12)17(18-13(21)6-2-7-14(18)22)19-15(23)8-3-9-16(19)24/h1,4-5,10,17,21,23H,2-3,6-9H2