2-[(4-nitro-3-oxidanyl-3-phenyl-2H-thiophen-5-yl)sulfanyl]-1-phenyl-ethanone

Systemtic Name: 2-[(4-nitro-3-oxidanyl-3-phenyl-2H-thiophen-5-yl)sulfanyl]-1-phenyl-ethanone Openeye Name: 2-[(3-hydroxy-4-nitro-3-phenyl-2H-thiophen-5-yl)sulfanyl]-1-phenyl-ethanone CAS Name: 2-[(3-hydroxy-4-nitro-3-phenyl-2H-thiophen-5-yl)thio]-1-phenylethanone IUPAC Name: 2-[(3-hydroxy-4-nitro-3-phenyl-2H-thiophen-5-yl)sulfanyl]-1-phenylethanone Traditional Name: 2-[(3-hydroxy-4-nitro-3-phenyl-2H-thiophen-5-yl)thio]-1-phenyl-ethanone Formula: C18H15NO4S2 MolecularWeight: 373.446

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=C(S1)SCC(=O)C2=CC=CC=C2)[N+](=O)[O-])(C3=CC=CC=C3)O

Isomeric SMILES

C1C(C(=C(S1)SCC(=O)C2=CC=CC=C2)[N+](=O)[O-])(C3=CC=CC=C3)O

InChI

InChI=1S/C18H15NO4S2/c20-15(13-7-3-1-4-8-13)11-24-17-16(19(22)23)18(21,12-25-17)14-9-5-2-6-10-14/h1-10,21H,11-12H2