2-[7-[4-[(4-nitrophenyl)diazenyl]phenoxy]heptoxycarbonyl]terephthalic acid

Systemtic Name: 2-[7-[4-[(4-nitrophenyl)diazenyl]phenoxy]heptoxycarbonyl]terephthalic acid Openeye Name: 2-[7-[4-(4-nitrophenyl)azophenoxy]heptoxycarbonyl]terephthalic acid CAS Name: 2-[7-[4-(4-nitrophenyl)azophenoxy]heptoxy-oxomethyl]terephthalic acid IUPAC Name: 2-[7-[4-[(4-nitrophenyl)diazenyl]phenoxy]heptoxycarbonyl]terephthalic acid Traditional Name: 2-[7-[4-(4-nitrophenyl)azophenoxy]heptoxycarbonyl]terephthalic acid Formula: C28H27N3O9 MolecularWeight: 549.52868

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C28H27N3O9/c32-26(33)19-6-15-24(27(34)35)25(18-19)28(36)40-17-5-3-1-2-4-16-39-23-13-9-21(10-14-23)30-29-20-7-11-22(12-8-20)31(37)38/h6-15,18H,1-5,16-17H2,(H,32,33)(H,34,35)