(NE)-N-[[3-nitro-4-(phenylmethylsulfanyl)phenyl]methylidene]hydroxylamine

Systemtic Name: (NE)-N-[[3-nitro-4-(phenylmethylsulfanyl)phenyl]methylidene]hydroxylamine Openeye Name: (1E)-4-benzylsulfanyl-3-nitro-benzaldehyde oxime CAS Name: (1E)-3-nitro-4-(phenylmethylthio)benzaldehyde oxime IUPAC Name: (NE)-N-[(4-benzylsulfanyl-3-nitrophenyl)methylidene]hydroxylamine Traditional Name: (1E)-4-(benzylthio)-3-nitro-benzaldoxime Formula: C14H12N2O3S MolecularWeight: 288.32168

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=C(C=C(C=C2)C=NO)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CSC2=C(C=C(C=C2)/C=N/O)[N+](=O)[O-]

InChI

InChI=1S/C14H12N2O3S/c17-15-9-12-6-7-14(13(8-12)16(18)19)20-10-11-4-2-1-3-5-11/h1-9,17H,10H2/b15-9+