N-[(2-methoxy-5-nitro-phenyl)methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[(2-methoxy-5-nitro-phenyl)methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-[(2-methoxy-5-nitro-phenyl)methyleneamino]-5-nitro-benzothiophene-2-carboxamide CAS Name: N-[(2-methoxy-5-nitrophenyl)methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-[(2-methoxy-5-nitrophenyl)methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-[(2-methoxy-5-nitro-benzylidene)amino]-5-nitro-benzothiophene-2-carboxamide Formula: C17H12N4O6S MolecularWeight: 400.36538

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])C=NNC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])C=NNC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H12N4O6S/c1-27-14-4-2-12(20(23)24)7-11(14)9-18-19-17(22)16-8-10-6-13(21(25)26)3-5-15(10)28-16/h2-9H,1H3,(H,19,22)