4-[2-(3,4-dicarboxy-2-phenoxy-phenyl)propan-2-yl]-3-phenoxy-phthalic acid

Systemtic Name: 4-[2-(3,4-dicarboxy-2-phenoxy-phenyl)propan-2-yl]-3-phenoxy-phthalic acid Openeye Name: 4-[1-(3,4-dicarboxy-2-phenoxy-phenyl)-1-methyl-ethyl]-3-phenoxy-phthalic acid CAS Name: 4-[2-(3,4-dicarboxy-2-phenoxyphenyl)propan-2-yl]-3-phenoxyphthalic acid IUPAC Name: 4-[2-(3,4-dicarboxy-2-phenoxyphenyl)propan-2-yl]-3-phenoxyphthalic acid Traditional Name: 4-[1-(3,4-dicarboxy-2-phenoxy-phenyl)-1-methyl-ethyl]-3-phenoxy-phthalic acid Formula: C31H24O10 MolecularWeight: 556.51626

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=C(C(=C(C=C1)C(=O)O)C(=O)O)OC2=CC=CC=C2)C3=C(C(=C(C=C3)C(=O)O)C(=O)O)OC4=CC=CC=C4

Isomeric SMILES

CC(C)(C1=C(C(=C(C=C1)C(=O)O)C(=O)O)OC2=CC=CC=C2)C3=C(C(=C(C=C3)C(=O)O)C(=O)O)OC4=CC=CC=C4

InChI

InChI=1S/C31H24O10/c1-31(2,21-15-13-19(27(32)33)23(29(36)37)25(21)40-17-9-5-3-6-10-17)22-16-14-20(28(34)35)24(30(38)39)26(22)41-18-11-7-4-8-12-18/h3-16H,1-2H3,(H,32,33)(H,34,35)(H,36,37)(H,38,39)