(4-ethanoylphenyl) 5-nitro-1-benzothiophene-2-carboxylate

Systemtic Name: (4-ethanoylphenyl) 5-nitro-1-benzothiophene-2-carboxylate Openeye Name: (4-acetylphenyl) 5-nitrobenzothiophene-2-carboxylate CAS Name: 5-nitro-1-benzothiophene-2-carboxylic acid (4-acetylphenyl) ester IUPAC Name: (4-acetylphenyl) 5-nitro-1-benzothiophene-2-carboxylate Traditional Name: 5-nitrobenzothiophene-2-carboxylic acid (4-acetylphenyl) ester Formula: C17H11NO5S MolecularWeight: 341.33794

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H11NO5S/c1-10(19)11-2-5-14(6-3-11)23-17(20)16-9-12-8-13(18(21)22)4-7-15(12)24-16/h2-9H,1H3