N-[[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-ethoxy-phenyl]methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-ethoxy-phenyl]methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-[[4-(2-amino-2-oxo-ethoxy)-3-ethoxy-phenyl]methyleneamino]-5-nitro-benzothiophene-2-carboxamide CAS Name: N-[[4-(2-amino-2-oxoethoxy)-3-ethoxyphenyl]methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-[[4-(2-amino-2-oxoethoxy)-3-ethoxyphenyl]methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-[[4-(2-amino-2-keto-ethoxy)-3-ethoxy-benzylidene]amino]-5-nitro-benzothiophene-2-carboxamide Formula: C20H18N4O6S MolecularWeight: 442.44512

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18N4O6S/c1-2-29-16-7-12(3-5-15(16)30-11-19(21)25)10-22-23-20(26)18-9-13-8-14(24(27)28)4-6-17(13)31-18/h3-10H,2,11H2,1H3,(H2,21,25)(H,23,26)