2-[4-[4-[(4-dimethylaminophenyl)diazenyl]phenoxy]butoxycarbonyl]terephthalic acid

Systemtic Name: 2-[4-[4-[(4-dimethylaminophenyl)diazenyl]phenoxy]butoxycarbonyl]terephthalic acid Openeye Name: 2-[4-[4-(4-dimethylaminophenyl)azophenoxy]butoxycarbonyl]terephthalic acid CAS Name: 2-[4-[4-(4-dimethylaminophenyl)azophenoxy]butoxy-oxomethyl]terephthalic acid IUPAC Name: 2-[4-[4-[(4-dimethylaminophenyl)diazenyl]phenoxy]butoxycarbonyl]terephthalic acid Traditional Name: 2-[4-[4-(4-dimethylaminophenyl)azophenoxy]butoxycarbonyl]terephthalic acid Formula: C27H27N3O7 MolecularWeight: 505.51918

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)OCCCCOC(=O)C3=C(C=CC(=C3)C(=O)O)C(=O)O

Isomeric SMILES

CN(C)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)OCCCCOC(=O)C3=C(C=CC(=C3)C(=O)O)C(=O)O

InChI

InChI=1S/C27H27N3O7/c1-30(2)21-10-6-19(7-11-21)28-29-20-8-12-22(13-9-20)36-15-3-4-16-37-27(35)24-17-18(25(31)32)5-14-23(24)26(33)34/h5-14,17H,3-4,15-16H2,1-2H3,(H,31,32)(H,33,34)