(2-bromophenyl)methyl 5-nitrothiophene-2-carboxylate

Systemtic Name: (2-bromophenyl)methyl 5-nitrothiophene-2-carboxylate Openeye Name: (2-bromophenyl)methyl 5-nitrothiophene-2-carboxylate CAS Name: 5-nitro-2-thiophenecarboxylic acid (2-bromophenyl)methyl ester IUPAC Name: (2-bromophenyl)methyl 5-nitrothiophene-2-carboxylate Traditional Name: 5-nitrothiophene-2-carboxylic acid (2-bromobenzyl) ester Formula: C12H8BrNO4S MolecularWeight: 342.16522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H8BrNO4S/c13-9-4-2-1-3-8(9)7-18-12(15)10-5-6-11(19-10)14(16)17/h1-6H,7H2