2-[[4-[(2-cyano-4-nitro-phenyl)diazenyl]phenyl]-(2-methoxycarbonyloxyethyl)amino]ethyl methyl carbonate

Systemtic Name: 2-[[4-[(2-cyano-4-nitro-phenyl)diazenyl]phenyl]-(2-methoxycarbonyloxyethyl)amino]ethyl methyl carbonate Openeye Name: 2-[4-(2-cyano-4-nitro-phenyl)azo-N-(2-methoxycarbonyloxyethyl)anilino]ethyl methyl carbonate CAS Name: carbonic acid 2-[4-(2-cyano-4-nitrophenyl)azo-N-(2-methoxycarbonyloxyethyl)anilino]ethyl methyl ester IUPAC Name: 2-[4-[(2-cyano-4-nitrophenyl)diazenyl]-N-(2-methoxycarbonyloxyethyl)anilino]ethyl methyl carbonate Traditional Name: carbonic acid 2-[N-(2-carbomethoxyoxyethyl)-4-(2-cyano-4-nitro-phenyl)azo-anilino]ethyl methyl ester Formula: C21H21N5O8 MolecularWeight: 471.42014

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)OCCN(CCOC(=O)OC)C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)[N+](=O)[O-])C#N

Isomeric SMILES

COC(=O)OCCN(CCOC(=O)OC)C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)[N+](=O)[O-])C#N

InChI

InChI=1S/C21H21N5O8/c1-31-20(27)33-11-9-25(10-12-34-21(28)32-2)17-5-3-16(4-6-17)23-24-19-8-7-18(26(29)30)13-15(19)14-22/h3-8,13H,9-12H2,1-2H3