2-[9-[4-[(4-nitrophenyl)diazenyl]phenoxy]nonoxycarbonyl]terephthalic acid

Systemtic Name: 2-[9-[4-[(4-nitrophenyl)diazenyl]phenoxy]nonoxycarbonyl]terephthalic acid Openeye Name: 2-[9-[4-(4-nitrophenyl)azophenoxy]nonoxycarbonyl]terephthalic acid CAS Name: 2-[9-[4-(4-nitrophenyl)azophenoxy]nonoxy-oxomethyl]terephthalic acid IUPAC Name: 2-[9-[4-[(4-nitrophenyl)diazenyl]phenoxy]nonoxycarbonyl]terephthalic acid Traditional Name: 2-[9-[4-(4-nitrophenyl)azophenoxy]nonoxycarbonyl]terephthalic acid Formula: C30H31N3O9 MolecularWeight: 577.58184

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N=NC2=CC=C(C=C2)OCCCCCCCCCOC(=O)C3=C(C=CC(=C3)C(=O)O)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1N=NC2=CC=C(C=C2)OCCCCCCCCCOC(=O)C3=C(C=CC(=C3)C(=O)O)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C30H31N3O9/c34-28(35)21-8-17-26(29(36)37)27(20-21)30(38)42-19-7-5-3-1-2-4-6-18-41-25-15-11-23(12-16-25)32-31-22-9-13-24(14-10-22)33(39)40/h8-17,20H,1-7,18-19H2,(H,34,35)(H,36,37)