2-nitro-4-(4-nitrophenyl)sulfanyl-aniline

Systemtic Name: 2-nitro-4-(4-nitrophenyl)sulfanyl-aniline Openeye Name: 2-nitro-4-(4-nitrophenyl)sulfanyl-aniline CAS Name: 2-nitro-4-[(4-nitrophenyl)thio]aniline IUPAC Name: 2-nitro-4-(4-nitrophenyl)sulfanylaniline Traditional Name: [2-nitro-4-[(4-nitrophenyl)thio]phenyl]amine Formula: C12H9N3O4S MolecularWeight: 291.28256

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1[N+](=O)[O-])SC2=CC(=C(C=C2)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1[N+](=O)[O-])SC2=CC(=C(C=C2)N)[N+](=O)[O-]

InChI

InChI=1S/C12H9N3O4S/c13-11-6-5-10(7-12(11)15(18)19)20-9-3-1-8(2-4-9)14(16)17/h1-7H,13H2