N2-(3-chlorophenyl)-N3-(2,5-dimethylphenyl)-6,7-dinitro-quinoxaline-2,3-diamine

Systemtic Name: N2-(3-chlorophenyl)-N3-(2,5-dimethylphenyl)-6,7-dinitro-quinoxaline-2,3-diamine Openeye Name: N2-(3-chlorophenyl)-N3-(2,5-dimethylphenyl)-6,7-dinitro-quinoxaline-2,3-diamine CAS Name: N2-(3-chlorophenyl)-N3-(2,5-dimethylphenyl)-6,7-dinitroquinoxaline-2,3-diamine IUPAC Name: 2-N-(3-chlorophenyl)-3-N-(2,5-dimethylphenyl)-6,7-dinitroquinoxaline-2,3-diamine Traditional Name: [3-(3-chloroanilino)-6,7-dinitro-quinoxalin-2-yl]-(2,5-dimethylphenyl)amine Formula: C22H17ClN6O4 MolecularWeight: 464.86118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC2=NC3=CC(=C(C=C3N=C2NC4=CC(=CC=C4)Cl)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC2=NC3=CC(=C(C=C3N=C2NC4=CC(=CC=C4)Cl)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C22H17ClN6O4/c1-12-6-7-13(2)16(8-12)25-22-21(24-15-5-3-4-14(23)9-15)26-17-10-19(28(30)31)20(29(32)33)11-18(17)27-22/h3-11H,1-2H3,(H,24,26)(H,25,27)