N-[(E)-(5-nitrothiophen-2-yl)methylideneamino]-3-oxidanyl-benzamide

Systemtic Name: N-[(E)-(5-nitrothiophen-2-yl)methylideneamino]-3-oxidanyl-benzamide Openeye Name: 3-hydroxy-N-[(E)-(5-nitro-2-thienyl)methyleneamino]benzamide CAS Name: 3-hydroxy-N-[(E)-(5-nitro-2-thiophenyl)methylideneamino]benzamide IUPAC Name: 3-hydroxy-N-[(E)-(5-nitrothiophen-2-yl)methylideneamino]benzamide Traditional Name: 3-hydroxy-N-[(E)-(5-nitro-2-thienyl)methyleneamino]benzamide Formula: C12H9N3O4S MolecularWeight: 291.28256

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)O)C(=O)NN=CC2=CC=C(S2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)O)C(=O)N/N=C/C2=CC=C(S2)[N+](=O)[O-]

InChI

InChI=1S/C12H9N3O4S/c16-9-3-1-2-8(6-9)12(17)14-13-7-10-4-5-11(20-10)15(18)19/h1-7,16H,(H,14,17)/b13-7+