N-(2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino)-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino)-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyleneamino)-5-nitro-benzothiophene-2-carboxamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino)-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino)-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyleneamino)-5-nitro-benzothiophene-2-carboxamide Formula: C18H13N3O5S MolecularWeight: 383.37792

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C=NNC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C=NNC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H13N3O5S/c22-18(17-9-12-8-13(21(23)24)2-4-16(12)27-17)20-19-10-11-1-3-14-15(7-11)26-6-5-25-14/h1-4,7-10H,5-6H2,(H,20,22)