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

Systemtic Name: (1E,4Z,6E)-1,7-bis(3-methoxy-4-phenylmethoxy-phenyl)-5-oxidanyl-hepta-1,4,6-trien-3-one Openeye Name: (1E,4Z,6E)-1,7-bis(4-benzyloxy-3-methoxy-phenyl)-5-hydroxy-hepta-1,4,6-trien-3-one CAS Name: (1E,4Z,6E)-5-hydroxy-1,7-bis(3-methoxy-4-phenylmethoxyphenyl)-3-hepta-1,4,6-trienone IUPAC Name: (1E,4Z,6E)-5-hydroxy-1,7-bis(3-methoxy-4-phenylmethoxyphenyl)hepta-1,4,6-trien-3-one Traditional Name: (1E,4Z,6E)-1,7-bis(4-benzoxy-3-methoxy-phenyl)-5-hydroxy-hepta-1,4,6-trien-3-one Formula: C35H32O6 MolecularWeight: 548.62498

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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)OCC3=CC=CC=C3)OC)O)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=C/C(=O)/C=C/C2=CC(=C(C=C2)OCC3=CC=CC=C3)OC)/O)OCC4=CC=CC=C4

InChI

InChI=1S/C35H32O6/c1-38-34-21-26(15-19-32(34)40-24-28-9-5-3-6-10-28)13-17-30(36)23-31(37)18-14-27-16-20-33(35(22-27)39-2)41-25-29-11-7-4-8-12-29/h3-23,36H,24-25H2,1-2H3/b17-13+,18-14+,30-23-