methyl 2-azanyl-4-(4-chloranyl-3-nitro-phenyl)thiophene-3-carboxylate

Systemtic Name: methyl 2-azanyl-4-(4-chloranyl-3-nitro-phenyl)thiophene-3-carboxylate Openeye Name: methyl 2-amino-4-(4-chloro-3-nitro-phenyl)thiophene-3-carboxylate CAS Name: 2-amino-4-(4-chloro-3-nitrophenyl)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-amino-4-(4-chloro-3-nitrophenyl)thiophene-3-carboxylate Traditional Name: 2-amino-4-(4-chloro-3-nitro-phenyl)thiophene-3-carboxylic acid methyl ester Formula: C12H9ClN2O4S MolecularWeight: 312.72886

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC=C1C2=CC(=C(C=C2)Cl)[N+](=O)[O-])N

Isomeric SMILES

COC(=O)C1=C(SC=C1C2=CC(=C(C=C2)Cl)[N+](=O)[O-])N

InChI

InChI=1S/C12H9ClN2O4S/c1-19-12(16)10-7(5-20-11(10)14)6-2-3-8(13)9(4-6)15(17)18/h2-5H,14H2,1H3