N-[(4-nitrophenyl)methoxy]-1-[3-nitro-4-(phenylmethylsulfanyl)phenyl]methanimine

Systemtic Name: N-[(4-nitrophenyl)methoxy]-1-[3-nitro-4-(phenylmethylsulfanyl)phenyl]methanimine Openeye Name: 1-(4-benzylsulfanyl-3-nitro-phenyl)-N-[(4-nitrophenyl)methoxy]methanimine CAS Name: N-[(4-nitrophenyl)methoxy]-1-[3-nitro-4-(phenylmethylthio)phenyl]methanimine IUPAC Name: 1-(4-benzylsulfanyl-3-nitrophenyl)-N-[(4-nitrophenyl)methoxy]methanimine Traditional Name: (E)-[4-(benzylthio)-3-nitro-benzylidene]-(4-nitrobenzyl)oxy-amine Formula: C21H17N3O5S MolecularWeight: 423.44178

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=C(C=C(C=C2)C=NOCC3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CSC2=C(C=C(C=C2)/C=N/OCC3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C21H17N3O5S/c25-23(26)19-9-6-16(7-10-19)14-29-22-13-18-8-11-21(20(12-18)24(27)28)30-15-17-4-2-1-3-5-17/h1-13H,14-15H2/b22-13+