[4-[6-[2,5-bis[[4-(9-prop-2-enoyloxynonoxy)phenoxy]carbonyl]phenyl]carbonyloxyhexoxy]phenyl]-(4-nitrophenyl)imino-oxidanidyl-azanium

Systemtic Name: [4-[6-[2,5-bis[[4-(9-prop-2-enoyloxynonoxy)phenoxy]carbonyl]phenyl]carbonyloxyhexoxy]phenyl]-(4-nitrophenyl)imino-oxidanidyl-azanium Openeye Name: [4-[6-[2,5-bis[[4-(9-prop-2-enoyloxynonoxy)phenoxy]carbonyl]benzoyl]oxyhexoxy]phenyl]-(4-nitrophenyl)imino-oxido-ammonium CAS Name: [4-[6-[[2,5-bis[oxo-[4-[9-(1-oxoprop-2-enoxy)nonoxy]phenoxy]methyl]phenyl]-oxomethoxy]hexoxy]phenyl]-(4-nitrophenyl)imino-oxidoammonium IUPAC Name: [4-[6-[2,5-bis[[4-(9-prop-2-enoyloxynonoxy)phenoxy]carbonyl]benzoyl]oxyhexoxy]phenyl]-(4-nitrophenyl)imino-oxidoazanium Traditional Name: [4-[6-[2,5-bis[[4-(9-acryloyloxynonoxy)phenoxy]carbonyl]benzoyl]oxyhexoxy]phenyl]-(4-nitrophenyl)imino-oxido-ammonium Formula: C63H73N3O16 MolecularWeight: 1128.26422

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)OCCCCCCCCCOC1=CC=C(C=C1)OC(=O)C2=CC(=C(C=C2)C(=O)OC3=CC=C(C=C3)OCCCCCCCCCOC(=O)C=C)C(=O)OCCCCCCOC4=CC=C(C=C4)[N+](=NC5=CC=C(C=C5)[N+](=O)[O-])[O-]

Isomeric SMILES

C=CC(=O)OCCCCCCCCCOC1=CC=C(C=C1)OC(=O)C2=CC(=C(C=C2)C(=O)OC3=CC=C(C=C3)OCCCCCCCCCOC(=O)C=C)C(=O)OCCCCCCOC4=CC=C(C=C4)[N+](=NC5=CC=C(C=C5)[N+](=O)[O-])[O-]

InChI

InChI=1S/C63H73N3O16/c1-3-59(67)78-44-20-13-9-5-7-11-17-41-76-53-32-36-55(37-33-53)81-61(69)48-23-40-57(63(71)82-56-38-34-54(35-39-56)77-42-18-12-8-6-10-14-21-45-79-60(68)4-2)58(47-48)62(70)80-46-22-16-15-19-43-75-52-30-28-50(29-31-52)65(72)64-49-24-26-51(27-25-49)66(73)74/h3-4,23-40,47H,1-2,5-22,41-46H2