4-[2-carboxy-6-[3-carboxy-2-(3,4-dicarboxyphenyl)phenoxy]phenyl]phthalic acid

Systemtic Name: 4-[2-carboxy-6-[3-carboxy-2-(3,4-dicarboxyphenyl)phenoxy]phenyl]phthalic acid Openeye Name: 4-[2-carboxy-6-[3-carboxy-2-(3,4-dicarboxyphenyl)phenoxy]phenyl]phthalic acid CAS Name: 4-[2-carboxy-6-[3-carboxy-2-(3,4-dicarboxyphenyl)phenoxy]phenyl]phthalic acid IUPAC Name: 4-[2-carboxy-6-[3-carboxy-2-(3,4-dicarboxyphenyl)phenoxy]phenyl]phthalic acid Traditional Name: 4-[2-carboxy-6-[3-carboxy-2-(3,4-dicarboxyphenyl)phenoxy]phenyl]phthalic acid Formula: C30H18O13 MolecularWeight: 586.45612

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)OC2=CC=CC(=C2C3=CC(=C(C=C3)C(=O)O)C(=O)O)C(=O)O)C4=CC(=C(C=C4)C(=O)O)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=C(C(=C1)OC2=CC=CC(=C2C3=CC(=C(C=C3)C(=O)O)C(=O)O)C(=O)O)C4=CC(=C(C=C4)C(=O)O)C(=O)O)C(=O)O

InChI

InChI=1S/C30H18O13/c31-25(32)15-9-7-13(11-19(15)29(39)40)23-17(27(35)36)3-1-5-21(23)43-22-6-2-4-18(28(37)38)24(22)14-8-10-16(26(33)34)20(12-14)30(41)42/h1-12H,(H,31,32)(H,33,34)(H,35,36)(H,37,38)(H,39,40)(H,41,42)