N-[(3,4-diethoxyphenyl)methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[(3,4-diethoxyphenyl)methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-[(3,4-diethoxyphenyl)methyleneamino]-5-nitro-benzothiophene-2-carboxamide CAS Name: N-[(3,4-diethoxyphenyl)methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-[(3,4-diethoxyphenyl)methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-[(3,4-diethoxybenzylidene)amino]-5-nitro-benzothiophene-2-carboxamide Formula: C20H19N3O5S MolecularWeight: 413.44696

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C=NNC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C=NNC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])OCC

InChI

InChI=1S/C20H19N3O5S/c1-3-27-16-7-5-13(9-17(16)28-4-2)12-21-22-20(24)19-11-14-10-15(23(25)26)6-8-18(14)29-19/h5-12H,3-4H2,1-2H3,(H,22,24)