(1E,4Z,6E)-7-(3-methoxy-4-oxidanyl-phenyl)-5-oxidanyl-1-thiophen-2-yl-hepta-1,4,6-trien-3-one

Systemtic Name: (1E,4Z,6E)-7-(3-methoxy-4-oxidanyl-phenyl)-5-oxidanyl-1-thiophen-2-yl-hepta-1,4,6-trien-3-one Openeye Name: (1E,4Z,6E)-5-hydroxy-7-(4-hydroxy-3-methoxy-phenyl)-1-(2-thienyl)hepta-1,4,6-trien-3-one CAS Name: (1E,4Z,6E)-5-hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-thiophen-2-yl-3-hepta-1,4,6-trienone IUPAC Name: (1E,4Z,6E)-5-hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-thiophen-2-ylhepta-1,4,6-trien-3-one Traditional Name: (1E,4Z,6E)-5-hydroxy-7-(4-hydroxy-3-methoxy-phenyl)-1-(2-thienyl)hepta-1,4,6-trien-3-one Formula: C18H16O4S MolecularWeight: 328.38224

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=CC(=O)C=CC2=CC=CS2)O)O

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=C/C(=O)/C=C/C2=CC=CS2)/O)O

InChI

InChI=1S/C18H16O4S/c1-22-18-11-13(5-9-17(18)21)4-6-14(19)12-15(20)7-8-16-3-2-10-23-16/h2-12,19,21H,1H3/b6-4+,8-7+,14-12-