3-nitro-N-[(3-nitrophenyl)amino]sulfanyl-aniline

Systemtic Name: 3-nitro-N-[(3-nitrophenyl)amino]sulfanyl-aniline Openeye Name: 3-nitro-N-(3-nitroanilino)sulfanyl-aniline CAS Name: 3-nitro-N-[(3-nitroanilino)thio]aniline IUPAC Name: 3-nitro-N-(3-nitroanilino)sulfanylaniline Traditional Name: [(3-nitroanilino)thio]-(3-nitrophenyl)amine Formula: C12H10N4O4S MolecularWeight: 306.2972

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])NSNC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])NSNC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H10N4O4S/c17-15(18)11-5-1-3-9(7-11)13-21-14-10-4-2-6-12(8-10)16(19)20/h1-8,13-14H