2-[[4-[5-[4-[(2-carboxyphenyl)amino]phenoxy]pentoxy]phenyl]amino]benzoic acid

Systemtic Name: 2-[[4-[5-[4-[(2-carboxyphenyl)amino]phenoxy]pentoxy]phenyl]amino]benzoic acid Openeye Name: 2-[4-[5-[4-(2-carboxyanilino)phenoxy]pentoxy]anilino]benzoic acid CAS Name: 2-[4-[5-[4-(2-carboxyanilino)phenoxy]pentoxy]anilino]benzoic acid IUPAC Name: 2-[4-[5-[4-(2-carboxyanilino)phenoxy]pentoxy]anilino]benzoic acid Traditional Name: 2-[4-[5-[4-(2-carboxyanilino)phenoxy]pentoxy]anilino]benzoic acid Formula: C31H30N2O6 MolecularWeight: 526.5797

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)NC2=CC=C(C=C2)OCCCCCOC3=CC=C(C=C3)NC4=CC=CC=C4C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)NC2=CC=C(C=C2)OCCCCCOC3=CC=C(C=C3)NC4=CC=CC=C4C(=O)O

InChI

InChI=1S/C31H30N2O6/c34-30(35)26-8-2-4-10-28(26)32-22-12-16-24(17-13-22)38-20-6-1-7-21-39-25-18-14-23(15-19-25)33-29-11-5-3-9-27(29)31(36)37/h2-5,8-19,32-33H,1,6-7,20-21H2,(H,34,35)(H,36,37)