8-[(4-nitrophenyl)carbamoyloxy]octa-3,5-diynyl N-(4-nitrophenyl)carbamate

Systemtic Name: 8-[(4-nitrophenyl)carbamoyloxy]octa-3,5-diynyl N-(4-nitrophenyl)carbamate Openeye Name: 8-[(4-nitrophenyl)carbamoyloxy]octa-3,5-diynyl N-(4-nitrophenyl)carbamate CAS Name: N-(4-nitrophenyl)carbamic acid 8-[(4-nitroanilino)-oxomethoxy]octa-3,5-diynyl ester IUPAC Name: 8-[(4-nitrophenyl)carbamoyloxy]octa-3,5-diynyl N-(4-nitrophenyl)carbamate Traditional Name: N-(4-nitrophenyl)carbamic acid 8-[(4-nitrophenyl)carbamoyloxy]octa-3,5-diynyl ester Formula: C22H18N4O8 MolecularWeight: 466.40032

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)OCCC#CC#CCCOC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NC(=O)OCCC#CC#CCCOC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C22H18N4O8/c27-21(23-17-7-11-19(12-8-17)25(29)30)33-15-5-3-1-2-4-6-16-34-22(28)24-18-9-13-20(14-10-18)26(31)32/h7-14H,5-6,15-16H2,(H,23,27)(H,24,28)