2-azanyl-5-[4-[1-[4-(4-azanyl-3-carboxy-phenoxy)phenyl]propyl]phenoxy]benzoic acid

Systemtic Name: 2-azanyl-5-[4-[1-[4-(4-azanyl-3-carboxy-phenoxy)phenyl]propyl]phenoxy]benzoic acid Openeye Name: 2-amino-5-[4-[1-[4-(4-amino-3-carboxy-phenoxy)phenyl]propyl]phenoxy]benzoic acid CAS Name: 2-amino-5-[4-[1-[4-(4-amino-3-carboxyphenoxy)phenyl]propyl]phenoxy]benzoic acid IUPAC Name: 2-amino-5-[4-[1-[4-(4-amino-3-carboxyphenoxy)phenyl]propyl]phenoxy]benzoic acid Traditional Name: 2-amino-5-[4-[1-[4-(4-amino-3-carboxy-phenoxy)phenyl]propyl]phenoxy]benzoic acid Formula: C29H26N2O6 MolecularWeight: 498.52654

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Descriptors Computed from Structure

Canonical SMILES:

CCC(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

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