N-[(2,4-dimethoxy-5-nitro-phenyl)methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[(2,4-dimethoxy-5-nitro-phenyl)methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-[(2,4-dimethoxy-5-nitro-phenyl)methyleneamino]-5-nitro-benzothiophene-2-carboxamide CAS Name: N-[(2,4-dimethoxy-5-nitrophenyl)methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-[(2,4-dimethoxy-5-nitrophenyl)methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-[(2,4-dimethoxy-5-nitro-benzylidene)amino]-5-nitro-benzothiophene-2-carboxamide Formula: C18H14N4O7S MolecularWeight: 430.39136

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C=NNC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])OC

Isomeric SMILES

COC1=CC(=C(C=C1C=NNC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])OC

InChI

InChI=1S/C18H14N4O7S/c1-28-14-8-15(29-2)13(22(26)27)6-11(14)9-19-20-18(23)17-7-10-5-12(21(24)25)3-4-16(10)30-17/h3-9H,1-2H3,(H,20,23)