N-[2-(dimethylamino)-2-oxidanylidene-ethyl]-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[2-(dimethylamino)-2-oxidanylidene-ethyl]-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-[2-(dimethylamino)-2-oxo-ethyl]-5-nitro-benzothiophene-2-carboxamide CAS Name: N-[2-(dimethylamino)-2-oxoethyl]-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-[2-(dimethylamino)-2-oxoethyl]-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-[2-(dimethylamino)-2-keto-ethyl]-5-nitro-benzothiophene-2-carboxamide Formula: C13H13N3O4S MolecularWeight: 307.32502

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CNC(=O)C1=CC2=C(S1)C=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

CN(C)C(=O)CNC(=O)C1=CC2=C(S1)C=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H13N3O4S/c1-15(2)12(17)7-14-13(18)11-6-8-5-9(16(19)20)3-4-10(8)21-11/h3-6H,7H2,1-2H3,(H,14,18)