12-(4-nitrophenyl)carbonyloxydodeca-1,11-diynyl 4-nitrobenzoate

Systemtic Name: 12-(4-nitrophenyl)carbonyloxydodeca-1,11-diynyl 4-nitrobenzoate Openeye Name: 12-(4-nitrobenzoyl)oxydodeca-1,11-diynyl 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid 12-[(4-nitrophenyl)-oxomethoxy]dodeca-1,11-diynyl ester IUPAC Name: 12-(4-nitrobenzoyl)oxydodeca-1,11-diynyl 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid 12-(4-nitrobenzoyl)oxydodeca-1,11-diynyl ester Formula: C26H24N2O8 MolecularWeight: 492.47736

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)OC#CCCCCCCCCC#COC(=O)C2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)OC#CCCCCCCCCC#COC(=O)C2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C26H24N2O8/c29-25(21-11-15-23(16-12-21)27(31)32)35-19-9-7-5-3-1-2-4-6-8-10-20-36-26(30)22-13-17-24(18-14-22)28(33)34/h11-18H,1-8H2