N-(1,3-benzodioxol-5-ylmethylideneamino)-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethylideneamino)-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyleneamino)-5-nitro-benzothiophene-2-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethylideneamino)-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethylideneamino)-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: 5-nitro-N-(piperonylideneamino)benzothiophene-2-carboxamide Formula: C17H11N3O5S MolecularWeight: 369.35134

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=NNC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C=NNC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C17H11N3O5S/c21-17(16-7-11-6-12(20(22)23)2-4-15(11)26-16)19-18-8-10-1-3-13-14(5-10)25-9-24-13/h1-8H,9H2,(H,19,21)