N-(4-methoxy-3-oxidanyl-phenyl)-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-(4-methoxy-3-oxidanyl-phenyl)-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-(3-hydroxy-4-methoxy-phenyl)-5-nitro-benzothiophene-2-carboxamide CAS Name: N-(3-hydroxy-4-methoxyphenyl)-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-(3-hydroxy-4-methoxyphenyl)-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-(3-hydroxy-4-methoxy-phenyl)-5-nitro-benzothiophene-2-carboxamide Formula: C16H12N2O5S MolecularWeight: 344.34188

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12N2O5S/c1-23-13-4-2-10(8-12(13)19)17-16(20)15-7-9-6-11(18(21)22)3-5-14(9)24-15/h2-8,19H,1H3,(H,17,20)