4,5-bis[1-[(E)-3-phenylprop-2-enoyl]oxypropan-2-yloxycarbonyl]phthalic acid

Systemtic Name: 4,5-bis[1-[(E)-3-phenylprop-2-enoyl]oxypropan-2-yloxycarbonyl]phthalic acid Openeye Name: 4,5-bis[[1-methyl-2-[(E)-3-phenylprop-2-enoyl]oxy-ethoxy]carbonyl]phthalic acid CAS Name: 4,5-bis[oxo-[1-[(E)-1-oxo-3-phenylprop-2-enoxy]propan-2-yloxy]methyl]phthalic acid IUPAC Name: 4,5-bis[1-[(E)-3-phenylprop-2-enoyl]oxypropan-2-yloxycarbonyl]phthalic acid Traditional Name: 4,5-bis[[1-methyl-2-[(E)-3-phenylacryloyl]oxy-ethoxy]carbonyl]phthalic acid Formula: C34H30O12 MolecularWeight: 630.5948

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC(=O)C=CC1=CC=CC=C1)OC(=O)C2=C(C=C(C(=C2)C(=O)O)C(=O)O)C(=O)OC(C)COC(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CC(OC(=O)C1=C(C=C(C(=C1)C(=O)O)C(=O)O)C(=O)OC(COC(=O)/C=C/C2=CC=CC=C2)C)COC(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C34H30O12/c1-21(19-43-29(35)15-13-23-9-5-3-6-10-23)45-33(41)27-17-25(31(37)38)26(32(39)40)18-28(27)34(42)46-22(2)20-44-30(36)16-14-24-11-7-4-8-12-24/h3-18,21-22H,19-20H2,1-2H3,(H,37,38)(H,39,40)/b15-13+,16-14+