2-[(4-hydroxyphenyl)-(2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl)methyl]-3-oxidanyl-cyclohex-2-en-1-one

Systemtic Name: 2-[(4-hydroxyphenyl)-(2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl)methyl]-3-oxidanyl-cyclohex-2-en-1-one Openeye Name: 3-hydroxy-2-[(2-hydroxy-6-oxo-cyclohexen-1-yl)-(4-hydroxyphenyl)methyl]cyclohex-2-en-1-one CAS Name: 3-hydroxy-2-[(2-hydroxy-6-oxo-1-cyclohexenyl)-(4-hydroxyphenyl)methyl]-1-cyclohex-2-enone IUPAC Name: 3-hydroxy-2-[(2-hydroxy-6-oxocyclohexen-1-yl)-(4-hydroxyphenyl)methyl]cyclohex-2-en-1-one Traditional Name: 3-hydroxy-2-[(2-hydroxy-6-keto-cyclohexen-1-yl)-(4-hydroxyphenyl)methyl]cyclohex-2-en-1-one Formula: C19H20O5 MolecularWeight: 328.3591

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20O5/c20-12-9-7-11(8-10-12)17(18-13(21)3-1-4-14(18)22)19-15(23)5-2-6-16(19)24/h7-10,17,20-21,23H,1-6H2