3-chloranyl-N-(4-chloranyl-2,5-dimethoxy-phenyl)-7-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-(4-chloranyl-2,5-dimethoxy-phenyl)-7-nitro-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-(4-chloro-2,5-dimethoxy-phenyl)-7-nitro-benzothiophene-2-carboxamide CAS Name: 3-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-7-nitro-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-7-nitro-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-(4-chloro-2,5-dimethoxy-phenyl)-7-nitro-benzothiophene-2-carboxamide Formula: C17H12Cl2N2O5S MolecularWeight: 427.25858

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)C2=C(C3=C(S2)C(=CC=C3)[N+](=O)[O-])Cl)OC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)C2=C(C3=C(S2)C(=CC=C3)[N+](=O)[O-])Cl)OC)Cl

InChI

InChI=1S/C17H12Cl2N2O5S/c1-25-12-7-10(13(26-2)6-9(12)18)20-17(22)16-14(19)8-4-3-5-11(21(23)24)15(8)27-16/h3-7H,1-2H3,(H,20,22)