2-[[4-[3,3-bis(4-methoxyphenyl)prop-2-enoxy]phenyl]methyl]propanedioic acid

Systemtic Name: 2-[[4-[3,3-bis(4-methoxyphenyl)prop-2-enoxy]phenyl]methyl]propanedioic acid Openeye Name: 2-[[4-[3,3-bis(4-methoxyphenyl)allyloxy]phenyl]methyl]propanedioic acid CAS Name: 2-[[4-[3,3-bis(4-methoxyphenyl)prop-2-enoxy]phenyl]methyl]propanedioic acid IUPAC Name: 2-[[4-[3,3-bis(4-methoxyphenyl)prop-2-enoxy]phenyl]methyl]propanedioic acid Traditional Name: 2-[4-[3,3-bis(4-methoxyphenyl)allyloxy]benzyl]malonic acid Formula: C27H26O7 MolecularWeight: 462.49114

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=CCOC2=CC=C(C=C2)CC(C(=O)O)C(=O)O)C3=CC=C(C=C3)OC

Isomeric SMILES

COC1=CC=C(C=C1)C(=CCOC2=CC=C(C=C2)CC(C(=O)O)C(=O)O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C27H26O7/c1-32-21-11-5-19(6-12-21)24(20-7-13-22(33-2)14-8-20)15-16-34-23-9-3-18(4-10-23)17-25(26(28)29)27(30)31/h3-15,25H,16-17H2,1-2H3,(H,28,29)(H,30,31)