N-[(6-ethoxy-1,3-benzodioxol-5-yl)methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[(6-ethoxy-1,3-benzodioxol-5-yl)methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-[(6-ethoxy-1,3-benzodioxol-5-yl)methyleneamino]-5-nitro-benzothiophene-2-carboxamide CAS Name: N-[(6-ethoxy-1,3-benzodioxol-5-yl)methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-[(6-ethoxy-1,3-benzodioxol-5-yl)methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-[(6-ethoxy-1,3-benzodioxol-5-yl)methyleneamino]-5-nitro-benzothiophene-2-carboxamide Formula: C19H15N3O6S MolecularWeight: 413.4039

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1C=NNC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-])OCO2

Isomeric SMILES

CCOC1=CC2=C(C=C1C=NNC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-])OCO2

InChI

InChI=1S/C19H15N3O6S/c1-2-26-14-8-16-15(27-10-28-16)6-12(14)9-20-21-19(23)18-7-11-5-13(22(24)25)3-4-17(11)29-18/h3-9H,2,10H2,1H3,(H,21,23)