4-(4-azanyl-3-nitro-phenyl)sulfinyl-2-nitro-aniline

Systemtic Name: 4-(4-azanyl-3-nitro-phenyl)sulfinyl-2-nitro-aniline Openeye Name: 4-(4-amino-3-nitro-phenyl)sulfinyl-2-nitro-aniline CAS Name: 4-(4-amino-3-nitrophenyl)sulfinyl-2-nitroaniline IUPAC Name: 4-(4-amino-3-nitrophenyl)sulfinyl-2-nitroaniline Traditional Name: [4-(4-amino-3-nitro-phenyl)sulfinyl-2-nitro-phenyl]amine Formula: C12H10N4O5S MolecularWeight: 322.2966

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)C2=CC(=C(C=C2)N)[N+](=O)[O-])[N+](=O)[O-])N

Isomeric SMILES

C1=CC(=C(C=C1S(=O)C2=CC(=C(C=C2)N)[N+](=O)[O-])[N+](=O)[O-])N

InChI

InChI=1S/C12H10N4O5S/c13-9-3-1-7(5-11(9)15(17)18)22(21)8-2-4-10(14)12(6-8)16(19)20/h1-6H,13-14H2