4-[(4-azanyl-3-nitro-phenyl)-bis(chloranyl)methyl]-2-nitro-aniline

Systemtic Name: 4-[(4-azanyl-3-nitro-phenyl)-bis(chloranyl)methyl]-2-nitro-aniline Openeye Name: 4-[(4-amino-3-nitro-phenyl)-dichloro-methyl]-2-nitro-aniline CAS Name: 4-[(4-amino-3-nitrophenyl)-dichloromethyl]-2-nitroaniline IUPAC Name: 4-[(4-amino-3-nitrophenyl)-dichloromethyl]-2-nitroaniline Traditional Name: [4-[(4-amino-3-nitro-phenyl)-dichloro-methyl]-2-nitro-phenyl]amine Formula: C13H10Cl2N4O4 MolecularWeight: 357.1489

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(C2=CC(=C(C=C2)N)[N+](=O)[O-])(Cl)Cl)[N+](=O)[O-])N

Isomeric SMILES

C1=CC(=C(C=C1C(C2=CC(=C(C=C2)N)[N+](=O)[O-])(Cl)Cl)[N+](=O)[O-])N

InChI

InChI=1S/C13H10Cl2N4O4/c14-13(15,7-1-3-9(16)11(5-7)18(20)21)8-2-4-10(17)12(6-8)19(22)23/h1-6H,16-17H2