4-oxidanyl-3-(4-prop-1-ynoxycarbonylphenyl)-6-[4-(4-prop-1-ynoxycarbonylphenyl)phenyl]phthalate

Systemtic Name: 4-oxidanyl-3-(4-prop-1-ynoxycarbonylphenyl)-6-[4-(4-prop-1-ynoxycarbonylphenyl)phenyl]phthalate Openeye Name: 4-hydroxy-3-(4-prop-1-ynoxycarbonylphenyl)-6-[4-(4-prop-1-ynoxycarbonylphenyl)phenyl]phthalate CAS Name: 4-hydroxy-3-[4-[oxo(prop-1-ynoxy)methyl]phenyl]-6-[4-[4-[oxo(prop-1-ynoxy)methyl]phenyl]phenyl]phthalate IUPAC Name: 4-hydroxy-3-(4-prop-1-ynoxycarbonylphenyl)-6-[4-(4-prop-1-ynoxycarbonylphenyl)phenyl]phthalate Traditional Name: 4-hydroxy-3-(4-prop-1-ynoxycarbonylphenyl)-6-[4-(4-prop-1-ynoxycarbonylphenyl)phenyl]phthalate Formula: C34H20O9-2 MolecularWeight: 572.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC#COC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC(=C(C(=C3C(=O)[O-])C(=O)[O-])C4=CC=C(C=C4)C(=O)OC#CC)O

Isomeric SMILES

CC#COC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC(=C(C(=C3C(=O)[O-])C(=O)[O-])C4=CC=C(C=C4)C(=O)OC#CC)O

InChI

InChI=1S/C34H22O9/c1-3-17-42-33(40)24-13-7-21(8-14-24)20-5-9-22(10-6-20)26-19-27(35)28(30(32(38)39)29(26)31(36)37)23-11-15-25(16-12-23)34(41)43-18-4-2/h5-16,19,35H,1-2H3,(H,36,37)(H,38,39)/p-2