2,5-bis(chloranyl)-4-nitro-aniline; 3,5-dinitroaniline

Systemtic Name: 2,5-bis(chloranyl)-4-nitro-aniline; 3,5-dinitroaniline Openeye Name: 2,5-dichloro-4-nitro-aniline; 3,5-dinitroaniline CAS Name: 2,5-dichloro-4-nitroaniline; 3,5-dinitroaniline IUPAC Name: 2,5-dichloro-4-nitroaniline; 3,5-dinitroaniline Traditional Name: (2,5-dichloro-4-nitro-phenyl)amine; (3,5-dinitrophenyl)amine Formula: C12H9Cl2N5O6 MolecularWeight: 390.13576

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])N.C1=C(C(=CC(=C1Cl)[N+](=O)[O-])Cl)N

Isomeric SMILES

C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])N.C1=C(C(=CC(=C1Cl)[N+](=O)[O-])Cl)N

InChI

InChI=1S/C6H4Cl2N2O2.C6H5N3O4/c7-3-2-6(10(11)12)4(8)1-5(3)9;7-4-1-5(8(10)11)3-6(2-4)9(12)13/h1-2H,9H2;1-3H,7H2