methyl 2-(5-nitrothiophen-2-yl)-3H-benzimidazole-5-carboxylate

Systemtic Name: methyl 2-(5-nitrothiophen-2-yl)-3H-benzimidazole-5-carboxylate Openeye Name: methyl 2-(5-nitro-2-thienyl)-3H-benzimidazole-5-carboxylate CAS Name: 2-(5-nitro-2-thiophenyl)-3H-benzimidazole-5-carboxylic acid methyl ester IUPAC Name: methyl 2-(5-nitrothiophen-2-yl)-3H-benzimidazole-5-carboxylate Traditional Name: 2-(5-nitro-2-thienyl)-3H-benzimidazole-5-carboxylic acid methyl ester Formula: C13H9N3O4S MolecularWeight: 303.29326

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)N=C(N2)C3=CC=C(S3)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)N=C(N2)C3=CC=C(S3)[N+](=O)[O-]

InChI

InChI=1S/C13H9N3O4S/c1-20-13(17)7-2-3-8-9(6-7)15-12(14-8)10-4-5-11(21-10)16(18)19/h2-6H,1H3,(H,14,15)