1-(4-chloranyl-3-nitro-phenyl)-2-pyridin-2-ylsulfanyl-ethanone

Systemtic Name: 1-(4-chloranyl-3-nitro-phenyl)-2-pyridin-2-ylsulfanyl-ethanone Openeye Name: 1-(4-chloro-3-nitro-phenyl)-2-(2-pyridylsulfanyl)ethanone CAS Name: 1-(4-chloro-3-nitrophenyl)-2-(2-pyridinylthio)ethanone IUPAC Name: 1-(4-chloro-3-nitrophenyl)-2-pyridin-2-ylsulfanylethanone Traditional Name: 1-(4-chloro-3-nitro-phenyl)-2-(2-pyridylthio)ethanone Formula: C13H9ClN2O3S MolecularWeight: 308.74016

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)SCC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=NC(=C1)SCC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C13H9ClN2O3S/c14-10-5-4-9(7-11(10)16(18)19)12(17)8-20-13-3-1-2-6-15-13/h1-7H,8H2