(1E,4Z,6E)-1,7-bis(3-methyl-4-oxidanyl-phenyl)-5-oxidanyl-hepta-1,4,6-trien-3-one

Systemtic Name: (1E,4Z,6E)-1,7-bis(3-methyl-4-oxidanyl-phenyl)-5-oxidanyl-hepta-1,4,6-trien-3-one Openeye Name: (1E,4Z,6E)-5-hydroxy-1,7-bis(4-hydroxy-3-methyl-phenyl)hepta-1,4,6-trien-3-one CAS Name: (1E,4Z,6E)-5-hydroxy-1,7-bis(4-hydroxy-3-methylphenyl)-3-hepta-1,4,6-trienone IUPAC Name: (1E,4Z,6E)-5-hydroxy-1,7-bis(4-hydroxy-3-methylphenyl)hepta-1,4,6-trien-3-one Traditional Name: (1E,4Z,6E)-5-hydroxy-1,7-bis(4-hydroxy-3-methyl-phenyl)hepta-1,4,6-trien-3-one Formula: C21H20O4 MolecularWeight: 336.3811

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C=CC(=CC(=O)C=CC2=CC(=C(C=C2)O)C)O)O

Isomeric SMILES

CC1=C(C=CC(=C1)/C=C/C(=C/C(=O)/C=C/C2=CC(=C(C=C2)O)C)/O)O

InChI

InChI=1S/C21H20O4/c1-14-11-16(5-9-20(14)24)3-7-18(22)13-19(23)8-4-17-6-10-21(25)15(2)12-17/h3-13,22,24-25H,1-2H3/b7-3+,8-4+,18-13-