[(4-nitrophenyl)amino]methylidene-(2-sulfanylethyl)azanium

Systemtic Name: [(4-nitrophenyl)amino]methylidene-(2-sulfanylethyl)azanium Openeye Name: (4-nitroanilino)methylene-(2-sulfanylethyl)ammonium CAS Name: 2-mercaptoethyl-[(4-nitroanilino)methylidene]ammonium IUPAC Name: (4-nitroanilino)methylidene-(2-sulfanylethyl)azanium Traditional Name: 2-mercaptoethyl-[(4-nitroanilino)methylene]ammonium Formula: C9H12N3O2S+ MolecularWeight: 226.27548

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC=[NH+]CCS)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NC=[NH+]CCS)[N+](=O)[O-]

InChI

InChI=1S/C9H11N3O2S/c13-12(14)9-3-1-8(2-4-9)11-7-10-5-6-15/h1-4,7,15H,5-6H2,(H,10,11)/p+1