2-(4-azanylphenoxy)-5-[2-[4-(4-azanylphenoxy)-3-carboxy-phenyl]propan-2-yl]benzoic acid

Systemtic Name: 2-(4-azanylphenoxy)-5-[2-[4-(4-azanylphenoxy)-3-carboxy-phenyl]propan-2-yl]benzoic acid Openeye Name: 2-(4-aminophenoxy)-5-[1-[4-(4-aminophenoxy)-3-carboxy-phenyl]-1-methyl-ethyl]benzoic acid CAS Name: 2-(4-aminophenoxy)-5-[2-[4-(4-aminophenoxy)-3-carboxyphenyl]propan-2-yl]benzoic acid IUPAC Name: 2-(4-aminophenoxy)-5-[2-[4-(4-aminophenoxy)-3-carboxyphenyl]propan-2-yl]benzoic acid Traditional Name: 2-(4-aminophenoxy)-5-[1-[4-(4-aminophenoxy)-3-carboxy-phenyl]-1-methyl-ethyl]benzoic acid Formula: C29H26N2O6 MolecularWeight: 498.52654

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H26N2O6/c1-29(2,17-3-13-25(23(15-17)27(32)33)36-21-9-5-19(30)6-10-21)18-4-14-26(24(16-18)28(34)35)37-22-11-7-20(31)8-12-22/h3-16H,30-31H2,1-2H3,(H,32,33)(H,34,35)