(4-nitrophenyl)methyl 5-bromanylthiophene-2-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 5-bromanylthiophene-2-carboxylate Openeye Name: (4-nitrophenyl)methyl 5-bromothiophene-2-carboxylate CAS Name: 5-bromo-2-thiophenecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 5-bromothiophene-2-carboxylate Traditional Name: 5-bromothiophene-2-carboxylic acid (4-nitrobenzyl) ester Formula: C12H8BrNO4S MolecularWeight: 342.16522

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1COC(=O)C2=CC=C(S2)Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1COC(=O)C2=CC=C(S2)Br)[N+](=O)[O-]

InChI

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