1-(furan-2-yl)-3-(2-hydroxyethylsulfanyl)-3-(4-nitrophenyl)propan-1-one

Systemtic Name: 1-(furan-2-yl)-3-(2-hydroxyethylsulfanyl)-3-(4-nitrophenyl)propan-1-one Openeye Name: 1-(2-furyl)-3-(2-hydroxyethylsulfanyl)-3-(4-nitrophenyl)propan-1-one CAS Name: 1-(2-furanyl)-3-(2-hydroxyethylthio)-3-(4-nitrophenyl)-1-propanone IUPAC Name: 1-(furan-2-yl)-3-(2-hydroxyethylsulfanyl)-3-(4-nitrophenyl)propan-1-one Traditional Name: 1-(2-furyl)-3-(2-hydroxyethylthio)-3-(4-nitrophenyl)propan-1-one Formula: C15H15NO5S MolecularWeight: 321.3483

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H15NO5S/c17-7-9-22-15(10-13(18)14-2-1-8-21-14)11-3-5-12(6-4-11)16(19)20/h1-6,8,15,17H,7,9-10H2