2-[[4-[4-[(4-nitrophenyl)diazenyl]phenyl]carbonyloxyphenyl]methoxycarbonyl]terephthalic acid; 10-phenoxydecyl prop-2-enoate

Systemtic Name: 2-[[4-[4-[(4-nitrophenyl)diazenyl]phenyl]carbonyloxyphenyl]methoxycarbonyl]terephthalic acid; 10-phenoxydecyl prop-2-enoate Openeye Name: 2-[[4-[4-(4-nitrophenyl)azobenzoyl]oxyphenyl]methoxycarbonyl]terephthalic acid; 10-phenoxydecyl prop-2-enoate CAS Name: 2-[[4-[[4-(4-nitrophenyl)azophenyl]-oxomethoxy]phenyl]methoxy-oxomethyl]terephthalic acid; 2-propenoic acid 10-phenoxydecyl ester IUPAC Name: 2-[[4-[4-[(4-nitrophenyl)diazenyl]benzoyl]oxyphenyl]methoxycarbonyl]terephthalic acid; 10-phenoxydecyl prop-2-enoate Traditional Name: acrylic acid 10-phenoxydecyl ester; 2-[4-[4-(4-nitrophenyl)azobenzoyl]oxybenzyl]oxycarbonylterephthalic acid Formula: C48H47N3O13 MolecularWeight: 873.89908

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)OCCCCCCCCCCOC1=CC=CC=C1.C1=CC(=CC=C1COC(=O)C2=C(C=CC(=C2)C(=O)O)C(=O)O)OC(=O)C3=CC=C(C=C3)N=NC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C=CC(=O)OCCCCCCCCCCOC1=CC=CC=C1.C1=CC(=CC=C1COC(=O)C2=C(C=CC(=C2)C(=O)O)C(=O)O)OC(=O)C3=CC=C(C=C3)N=NC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C29H19N3O10.C19H28O3/c33-26(34)19-5-14-24(27(35)36)25(15-19)29(38)41-16-17-1-12-23(13-2-17)42-28(37)18-3-6-20(7-4-18)30-31-21-8-10-22(11-9-21)32(39)40;1-2-19(20)22-17-13-8-6-4-3-5-7-12-16-21-18-14-10-9-11-15-18/h1-15H,16H2,(H,33,34)(H,35,36);2,9-11,14-15H,1,3-8,12-13,16-17H2