3-bromanyl-N-[(E)-(5-nitrothiophen-2-yl)methylideneamino]-4-oxidanyl-benzamide

Systemtic Name: 3-bromanyl-N-[(E)-(5-nitrothiophen-2-yl)methylideneamino]-4-oxidanyl-benzamide Openeye Name: 3-bromo-4-hydroxy-N-[(E)-(5-nitro-2-thienyl)methyleneamino]benzamide CAS Name: 3-bromo-4-hydroxy-N-[(E)-(5-nitro-2-thiophenyl)methylideneamino]benzamide IUPAC Name: 3-bromo-4-hydroxy-N-[(E)-(5-nitrothiophen-2-yl)methylideneamino]benzamide Traditional Name: 3-bromo-4-hydroxy-N-[(E)-(5-nitro-2-thienyl)methyleneamino]benzamide Formula: C12H8BrN3O4S MolecularWeight: 370.17862

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)NN=CC2=CC=C(S2)[N+](=O)[O-])Br)O

Isomeric SMILES

C1=CC(=C(C=C1C(=O)N/N=C/C2=CC=C(S2)[N+](=O)[O-])Br)O

InChI

InChI=1S/C12H8BrN3O4S/c13-9-5-7(1-3-10(9)17)12(18)15-14-6-8-2-4-11(21-8)16(19)20/h1-6,17H,(H,15,18)/b14-6+