methyl 3-azanyl-4-azido-6-nitro-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 3-azanyl-4-azido-6-nitro-1-benzothiophene-2-carboxylate Openeye Name: methyl 3-amino-4-azido-6-nitro-benzothiophene-2-carboxylate CAS Name: 3-amino-4-azido-6-nitro-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 3-amino-4-azido-6-nitro-1-benzothiophene-2-carboxylate Traditional Name: 3-amino-4-azido-6-nitro-benzothiophene-2-carboxylic acid methyl ester Formula: C10H7N5O4S MolecularWeight: 293.25868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=C(S1)C=C(C=C2N=[N+]=[N-])[N+](=O)[O-])N

Isomeric SMILES

COC(=O)C1=C(C2=C(S1)C=C(C=C2N=[N+]=[N-])[N+](=O)[O-])N

InChI

InChI=1S/C10H7N5O4S/c1-19-10(16)9-8(11)7-5(13-14-12)2-4(15(17)18)3-6(7)20-9/h2-3H,11H2,1H3