methyl 3-azanyl-4,6-dinitro-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 3-azanyl-4,6-dinitro-1-benzothiophene-2-carboxylate Openeye Name: methyl 3-amino-4,6-dinitro-benzothiophene-2-carboxylate CAS Name: 3-amino-4,6-dinitro-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 3-amino-4,6-dinitro-1-benzothiophene-2-carboxylate Traditional Name: 3-amino-4,6-dinitro-benzothiophene-2-carboxylic acid methyl ester Formula: C10H7N3O6S MolecularWeight: 297.24408

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=C(C=C(C=C2S1)[N+](=O)[O-])[N+](=O)[O-])N

Isomeric SMILES

COC(=O)C1=C(C2=C(C=C(C=C2S1)[N+](=O)[O-])[N+](=O)[O-])N

InChI

InChI=1S/C10H7N3O6S/c1-19-10(14)9-8(11)7-5(13(17)18)2-4(12(15)16)3-6(7)20-9/h2-3H,11H2,1H3