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

Systemtic Name: N-[[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-methoxy-phenyl]methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-[[4-(2-amino-2-oxo-ethoxy)-3-methoxy-phenyl]methyleneamino]-5-nitro-benzothiophene-2-carboxamide CAS Name: N-[[4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-[[4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-[[4-(2-amino-2-keto-ethoxy)-3-methoxy-benzylidene]amino]-5-nitro-benzothiophene-2-carboxamide Formula: C19H16N4O6S MolecularWeight: 428.41854

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=NNC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])OCC(=O)N

Isomeric SMILES

COC1=C(C=CC(=C1)C=NNC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])OCC(=O)N

InChI

InChI=1S/C19H16N4O6S/c1-28-15-6-11(2-4-14(15)29-10-18(20)24)9-21-22-19(25)17-8-12-7-13(23(26)27)3-5-16(12)30-17/h2-9H,10H2,1H3,(H2,20,24)(H,22,25)