2-[5-[4-[(4-nitrophenyl)diazenyl]phenoxy]pentoxycarbonyl]terephthalic acid

Systemtic Name: 2-[5-[4-[(4-nitrophenyl)diazenyl]phenoxy]pentoxycarbonyl]terephthalic acid Openeye Name: 2-[5-[4-(4-nitrophenyl)azophenoxy]pentoxycarbonyl]terephthalic acid CAS Name: 2-[5-[4-(4-nitrophenyl)azophenoxy]pentoxy-oxomethyl]terephthalic acid IUPAC Name: 2-[5-[4-[(4-nitrophenyl)diazenyl]phenoxy]pentoxycarbonyl]terephthalic acid Traditional Name: 2-[5-[4-(4-nitrophenyl)azophenoxy]pentoxycarbonyl]terephthalic acid Formula: C26H23N3O9 MolecularWeight: 521.47552

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C26H23N3O9/c30-24(31)17-4-13-22(25(32)33)23(16-17)26(34)38-15-3-1-2-14-37-21-11-7-19(8-12-21)28-27-18-5-9-20(10-6-18)29(35)36/h4-13,16H,1-3,14-15H2,(H,30,31)(H,32,33)