2-chloranyl-5-[(2E)-2-[[4-(2-hydroxyethylsulfanyl)-3-nitro-phenyl]methylidene]hydrazinyl]benzoate

Systemtic Name: 2-chloranyl-5-[(2E)-2-[[4-(2-hydroxyethylsulfanyl)-3-nitro-phenyl]methylidene]hydrazinyl]benzoate Openeye Name: 2-chloro-5-[(2E)-2-[[4-(2-hydroxyethylsulfanyl)-3-nitro-phenyl]methylene]hydrazino]benzoate CAS Name: 2-chloro-5-[(2E)-2-[[4-(2-hydroxyethylthio)-3-nitrophenyl]methylidene]hydrazinyl]benzoate IUPAC Name: 2-chloro-5-[(2E)-2-[[4-(2-hydroxyethylsulfanyl)-3-nitrophenyl]methylidene]hydrazinyl]benzoate Traditional Name: 2-chloro-5-[(N'E)-N'-[4-(2-hydroxyethylthio)-3-nitro-benzylidene]hydrazino]benzoate Formula: C16H13ClN3O5S- MolecularWeight: 394.80952

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C=NNC2=CC(=C(C=C2)Cl)C(=O)[O-])[N+](=O)[O-])SCCO

Isomeric SMILES

C1=CC(=C(C=C1/C=N/NC2=CC(=C(C=C2)Cl)C(=O)[O-])[N+](=O)[O-])SCCO

InChI

InChI=1S/C16H14ClN3O5S/c17-13-3-2-11(8-12(13)16(22)23)19-18-9-10-1-4-15(26-6-5-21)14(7-10)20(24)25/h1-4,7-9,19,21H,5-6H2,(H,22,23)/p-1/b18-9+