2-[[2,4-bis(azanyl)-5-methyl-phenyl]diazenyl]-4,6-dinitro-phenolate

Systemtic Name: 2-[[2,4-bis(azanyl)-5-methyl-phenyl]diazenyl]-4,6-dinitro-phenolate Openeye Name: 2-(2,4-diamino-5-methyl-phenyl)azo-4,6-dinitro-phenolate CAS Name: 2-(2,4-diamino-5-methylphenyl)azo-4,6-dinitrophenolate IUPAC Name: 2-[(2,4-diamino-5-methylphenyl)diazenyl]-4,6-dinitrophenolate Traditional Name: 2-(2,4-diamino-5-methyl-phenyl)azo-4,6-dinitro-phenolate Formula: C13H11N6O5- MolecularWeight: 331.26364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1N)N)N=NC2=CC(=CC(=C2[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1N)N)N=NC2=CC(=CC(=C2[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H12N6O5/c1-6-2-10(9(15)5-8(6)14)16-17-11-3-7(18(21)22)4-12(13(11)20)19(23)24/h2-5,20H,14-15H2,1H3/p-1