1-[1-(3-nitrophenyl)-4-thiophen-2-ylcarbonyl-pyrazol-3-yl]ethanone

Systemtic Name: 1-[1-(3-nitrophenyl)-4-thiophen-2-ylcarbonyl-pyrazol-3-yl]ethanone Openeye Name: 1-[1-(3-nitrophenyl)-4-(thiophene-2-carbonyl)pyrazol-3-yl]ethanone CAS Name: 1-[1-(3-nitrophenyl)-4-[oxo(thiophen-2-yl)methyl]-3-pyrazolyl]ethanone IUPAC Name: 1-[1-(3-nitrophenyl)-4-(thiophene-2-carbonyl)pyrazol-3-yl]ethanone Traditional Name: 1-[1-(3-nitrophenyl)-4-(2-thenoyl)pyrazol-3-yl]ethanone Formula: C16H11N3O4S MolecularWeight: 341.34124

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=NN(C=C1C(=O)C2=CC=CS2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=NN(C=C1C(=O)C2=CC=CS2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H11N3O4S/c1-10(20)15-13(16(21)14-6-3-7-24-14)9-18(17-15)11-4-2-5-12(8-11)19(22)23/h2-9H,1H3