2-[3-[4-[(4-dimethylaminophenyl)diazenyl]phenoxy]propoxycarbonyl]terephthalic acid; 6-phenoxyhexyl prop-2-enoate

Systemtic Name: 2-[3-[4-[(4-dimethylaminophenyl)diazenyl]phenoxy]propoxycarbonyl]terephthalic acid; 6-phenoxyhexyl prop-2-enoate Openeye Name: 2-[3-[4-(4-dimethylaminophenyl)azophenoxy]propoxycarbonyl]terephthalic acid; 6-phenoxyhexyl prop-2-enoate CAS Name: 2-[3-[4-(4-dimethylaminophenyl)azophenoxy]propoxy-oxomethyl]terephthalic acid; 2-propenoic acid 6-phenoxyhexyl ester IUPAC Name: 2-[3-[4-[(4-dimethylaminophenyl)diazenyl]phenoxy]propoxycarbonyl]terephthalic acid; 6-phenoxyhexyl prop-2-enoate Traditional Name: acrylic acid 6-phenoxyhexyl ester; 2-[3-[4-(4-dimethylaminophenyl)azophenoxy]propoxycarbonyl]terephthalic acid Formula: C41H45N3O10 MolecularWeight: 739.8101

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)OCCCOC(=O)C3=C(C=CC(=C3)C(=O)O)C(=O)O.C=CC(=O)OCCCCCCOC1=CC=CC=C1

Isomeric SMILES

CN(C)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)OCCCOC(=O)C3=C(C=CC(=C3)C(=O)O)C(=O)O.C=CC(=O)OCCCCCCOC1=CC=CC=C1

InChI

InChI=1S/C26H25N3O7.C15H20O3/c1-29(2)20-9-5-18(6-10-20)27-28-19-7-11-21(12-8-19)35-14-3-15-36-26(34)23-16-17(24(30)31)4-13-22(23)25(32)33;1-2-15(16)18-13-9-4-3-8-12-17-14-10-6-5-7-11-14/h4-13,16H,3,14-15H2,1-2H3,(H,30,31)(H,32,33);2,5-7,10-11H,1,3-4,8-9,12-13H2