11-[11-(4-nitrophenyl)carbonyloxyundecyldisulfanyl]undecyl 4-nitrobenzoate

Systemtic Name: 11-[11-(4-nitrophenyl)carbonyloxyundecyldisulfanyl]undecyl 4-nitrobenzoate Openeye Name: 11-[11-(4-nitrobenzoyl)oxyundecyldisulfanyl]undecyl 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid 11-[11-[(4-nitrophenyl)-oxomethoxy]undecyldisulfanyl]undecyl ester IUPAC Name: 11-[11-(4-nitrobenzoyl)oxyundecyldisulfanyl]undecyl 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid 11-[11-(4-nitrobenzoyl)oxyundecyldisulfanyl]undecyl ester Formula: C36H52N2O8S2 MolecularWeight: 704.93668

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)OCCCCCCCCCCCSSCCCCCCCCCCCOC(=O)C2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)OCCCCCCCCCCCSSCCCCCCCCCCCOC(=O)C2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C36H52N2O8S2/c39-35(31-19-23-33(24-20-31)37(41)42)45-27-15-11-7-3-1-5-9-13-17-29-47-48-30-18-14-10-6-2-4-8-12-16-28-46-36(40)32-21-25-34(26-22-32)38(43)44/h19-26H,1-18,27-30H2