2-(furan-2-ylmethylsulfanyl)-1-(4-nitrophenyl)ethanone

Systemtic Name: 2-(furan-2-ylmethylsulfanyl)-1-(4-nitrophenyl)ethanone Openeye Name: 2-(2-furylmethylsulfanyl)-1-(4-nitrophenyl)ethanone CAS Name: 2-(2-furanylmethylthio)-1-(4-nitrophenyl)ethanone IUPAC Name: 2-(furan-2-ylmethylsulfanyl)-1-(4-nitrophenyl)ethanone Traditional Name: 2-(2-furfurylthio)-1-(4-nitrophenyl)ethanone Formula: C13H11NO4S MolecularWeight: 277.29574

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CSCC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=COC(=C1)CSCC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H11NO4S/c15-13(9-19-8-12-2-1-7-18-12)10-3-5-11(6-4-10)14(16)17/h1-7H,8-9H2