4-[4-[4-carboxy-3-(hydroxymethyloxy)phenoxy]-2-diphenylphosphoryl-phenoxy]phthalic acid

Systemtic Name: 4-[4-[4-carboxy-3-(hydroxymethyloxy)phenoxy]-2-diphenylphosphoryl-phenoxy]phthalic acid Openeye Name: 4-[4-[4-carboxy-3-(hydroxymethoxy)phenoxy]-2-diphenylphosphoryl-phenoxy]phthalic acid CAS Name: 4-[4-[4-carboxy-3-(hydroxymethoxy)phenoxy]-2-diphenylphosphorylphenoxy]phthalic acid IUPAC Name: 4-[4-[4-carboxy-3-(hydroxymethoxy)phenoxy]-2-diphenylphosphorylphenoxy]phthalic acid Traditional Name: 4-[4-(4-carboxy-3-methyloloxy-phenoxy)-2-diphenylphosphoryl-phenoxy]phthalic acid Formula: C34H25O11P MolecularWeight: 640.529461

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)P(=O)(C2=CC=CC=C2)C3=C(C=CC(=C3)OC4=CC(=C(C=C4)C(=O)O)OCO)OC5=CC(=C(C=C5)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)P(=O)(C2=CC=CC=C2)C3=C(C=CC(=C3)OC4=CC(=C(C=C4)C(=O)O)OCO)OC5=CC(=C(C=C5)C(=O)O)C(=O)O

InChI

InChI=1S/C34H25O11P/c35-20-43-30-18-22(12-15-27(30)33(38)39)44-23-13-16-29(45-21-11-14-26(32(36)37)28(17-21)34(40)41)31(19-23)46(42,24-7-3-1-4-8-24)25-9-5-2-6-10-25/h1-19,35H,20H2,(H,36,37)(H,38,39)(H,40,41)