N-[(3,4-dichlorophenyl)methyl]-5,7-dinitro-3-phenyl-quinoxalin-2-amine

Systemtic Name: N-[(3,4-dichlorophenyl)methyl]-5,7-dinitro-3-phenyl-quinoxalin-2-amine Openeye Name: N-[(3,4-dichlorophenyl)methyl]-5,7-dinitro-3-phenyl-quinoxalin-2-amine CAS Name: N-[(3,4-dichlorophenyl)methyl]-5,7-dinitro-3-phenyl-2-quinoxalinamine IUPAC Name: N-[(3,4-dichlorophenyl)methyl]-5,7-dinitro-3-phenylquinoxalin-2-amine Traditional Name: (3,4-dichlorobenzyl)-(5,7-dinitro-3-phenyl-quinoxalin-2-yl)amine Formula: C21H13Cl2N5O4 MolecularWeight: 470.26502

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=C(C=C(C=C3N=C2NCC4=CC(=C(C=C4)Cl)Cl)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=C(C=C(C=C3N=C2NCC4=CC(=C(C=C4)Cl)Cl)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C21H13Cl2N5O4/c22-15-7-6-12(8-16(15)23)11-24-21-19(13-4-2-1-3-5-13)26-20-17(25-21)9-14(27(29)30)10-18(20)28(31)32/h1-10H,11H2,(H,24,25)