[(Z)-(5-nitrothiophen-2-yl)methylideneamino] 3-bromanylbenzoate

Systemtic Name: [(Z)-(5-nitrothiophen-2-yl)methylideneamino] 3-bromanylbenzoate Openeye Name: [(Z)-(5-nitro-2-thienyl)methyleneamino] 3-bromobenzoate CAS Name: 3-bromobenzoic acid [(Z)-(5-nitro-2-thiophenyl)methylideneamino] ester IUPAC Name: [(Z)-(5-nitrothiophen-2-yl)methylideneamino] 3-bromobenzoate Traditional Name: 3-bromobenzoic acid [(Z)-(5-nitro-2-thienyl)methyleneamino] ester Formula: C12H7BrN2O4S MolecularWeight: 355.16398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H7BrN2O4S/c13-9-3-1-2-8(6-9)12(16)19-14-7-10-4-5-11(20-10)15(17)18/h1-7H/b14-7-