(2-chloranyl-4-nitro-phenyl)methyl thiophene-2-carboxylate

Systemtic Name: (2-chloranyl-4-nitro-phenyl)methyl thiophene-2-carboxylate Openeye Name: (2-chloro-4-nitro-phenyl)methyl thiophene-2-carboxylate CAS Name: 2-thiophenecarboxylic acid (2-chloro-4-nitrophenyl)methyl ester IUPAC Name: (2-chloro-4-nitrophenyl)methyl thiophene-2-carboxylate Traditional Name: thiophene-2-carboxylic acid (2-chloro-4-nitro-benzyl) ester Formula: C12H8ClNO4S MolecularWeight: 297.71422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(=O)OCC2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CSC(=C1)C(=O)OCC2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C12H8ClNO4S/c13-10-6-9(14(16)17)4-3-8(10)7-18-12(15)11-2-1-5-19-11/h1-6H,7H2