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

Systemtic Name: (2-chlorophenyl)methyl 5-nitrothiophene-2-carboxylate Openeye Name: (2-chlorophenyl)methyl 5-nitrothiophene-2-carboxylate CAS Name: 5-nitro-2-thiophenecarboxylic acid (2-chlorophenyl)methyl ester IUPAC Name: (2-chlorophenyl)methyl 5-nitrothiophene-2-carboxylate Traditional Name: 5-nitrothiophene-2-carboxylic acid (2-chlorobenzyl) ester Formula: C12H8ClNO4S MolecularWeight: 297.71422

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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