6-[5-[bis(4-methoxyphenyl)-oxidanyl-methyl]-2-methoxy-phenyl]hex-5-ynoic acid

Systemtic Name: 6-[5-[bis(4-methoxyphenyl)-oxidanyl-methyl]-2-methoxy-phenyl]hex-5-ynoic acid Openeye Name: 6-[5-[hydroxy-bis(4-methoxyphenyl)methyl]-2-methoxy-phenyl]hex-5-ynoic acid CAS Name: 6-[5-[hydroxy-bis(4-methoxyphenyl)methyl]-2-methoxyphenyl]-5-hexynoic acid IUPAC Name: 6-[5-[hydroxy-bis(4-methoxyphenyl)methyl]-2-methoxyphenyl]hex-5-ynoic acid Traditional Name: 6-[5-[hydroxy-bis(4-methoxyphenyl)methyl]-2-methoxy-phenyl]hex-5-ynoic acid Formula: C28H28O6 MolecularWeight: 460.51832

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=CC=C(C=C2)OC)(C3=CC(=C(C=C3)OC)C#CCCCC(=O)O)O

Isomeric SMILES

COC1=CC=C(C=C1)C(C2=CC=C(C=C2)OC)(C3=CC(=C(C=C3)OC)C#CCCCC(=O)O)O

InChI

InChI=1S/C28H28O6/c1-32-24-14-9-21(10-15-24)28(31,22-11-16-25(33-2)17-12-22)23-13-18-26(34-3)20(19-23)7-5-4-6-8-27(29)30/h9-19,31H,4,6,8H2,1-3H3,(H,29,30)