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

Systemtic Name: 3-chloranyl-N-(4-methoxy-3,5-dinitro-phenyl)-7-nitro-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-(4-methoxy-3,5-dinitro-phenyl)-7-nitro-benzothiophene-2-carboxamide CAS Name: 3-chloro-N-(4-methoxy-3,5-dinitrophenyl)-7-nitro-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-(4-methoxy-3,5-dinitrophenyl)-7-nitro-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-(4-methoxy-3,5-dinitro-phenyl)-7-nitro-benzothiophene-2-carboxamide Formula: C16H9ClN4O8S MolecularWeight: 452.78266

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H9ClN4O8S/c1-29-13-10(20(25)26)5-7(6-11(13)21(27)28)18-16(22)15-12(17)8-3-2-4-9(19(23)24)14(8)30-15/h2-6H,1H3,(H,18,22)