methyl 5-nitro-2-(phenylazanyldiazenyl)benzoate

Systemtic Name: methyl 5-nitro-2-(phenylazanyldiazenyl)benzoate Openeye Name: methyl 2-anilinoazo-5-nitro-benzoate CAS Name: 2-anilinoazo-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 2-(anilinodiazenyl)-5-nitrobenzoate Traditional Name: 2-anilinoazo-5-nitro-benzoic acid methyl ester Formula: C14H12N4O4 MolecularWeight: 300.26948

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])N=NNC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])N=NNC2=CC=CC=C2

InChI

InChI=1S/C14H12N4O4/c1-22-14(19)12-9-11(18(20)21)7-8-13(12)16-17-15-10-5-3-2-4-6-10/h2-9H,1H3,(H,15,16)