(1E,4Z,6E)-1,7-bis(3-methoxy-4-prop-2-ynoxy-phenyl)-5-oxidanyl-hepta-1,4,6-trien-3-one

Systemtic Name: (1E,4Z,6E)-1,7-bis(3-methoxy-4-prop-2-ynoxy-phenyl)-5-oxidanyl-hepta-1,4,6-trien-3-one Openeye Name: (1E,4Z,6E)-5-hydroxy-1,7-bis(3-methoxy-4-prop-2-ynoxy-phenyl)hepta-1,4,6-trien-3-one CAS Name: (1E,4Z,6E)-5-hydroxy-1,7-bis(3-methoxy-4-prop-2-ynoxyphenyl)-3-hepta-1,4,6-trienone IUPAC Name: (1E,4Z,6E)-5-hydroxy-1,7-bis(3-methoxy-4-prop-2-ynoxyphenyl)hepta-1,4,6-trien-3-one Traditional Name: (1E,4Z,6E)-5-hydroxy-1,7-bis(3-methoxy-4-propargyloxy-phenyl)hepta-1,4,6-trien-3-one Formula: C27H24O6 MolecularWeight: 444.47586

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=CC(=O)C=CC2=CC(=C(C=C2)OCC#C)OC)O)OCC#C

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=C/C(=O)/C=C/C2=CC(=C(C=C2)OCC#C)OC)/O)OCC#C

InChI

InChI=1S/C27H24O6/c1-5-15-32-24-13-9-20(17-26(24)30-3)7-11-22(28)19-23(29)12-8-21-10-14-25(33-16-6-2)27(18-21)31-4/h1-2,7-14,17-19,28H,15-16H2,3-4H3/b11-7+,12-8+,22-19-