(5S)-2-(2-nitrophenyl)sulfanyl-3-oxidanyl-5-phenyl-cyclohex-2-en-1-one

Systemtic Name: (5S)-2-(2-nitrophenyl)sulfanyl-3-oxidanyl-5-phenyl-cyclohex-2-en-1-one Openeye Name: (5S)-3-hydroxy-2-(2-nitrophenyl)sulfanyl-5-phenyl-cyclohex-2-en-1-one CAS Name: (5S)-3-hydroxy-2-[(2-nitrophenyl)thio]-5-phenyl-1-cyclohex-2-enone IUPAC Name: (5S)-3-hydroxy-2-(2-nitrophenyl)sulfanyl-5-phenylcyclohex-2-en-1-one Traditional Name: (5S)-3-hydroxy-2-[(2-nitrophenyl)thio]-5-phenyl-cyclohex-2-en-1-one Formula: C18H15NO4S MolecularWeight: 341.381

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC(=O)C(=C1O)SC2=CC=CC=C2[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

C1[C@@H](CC(=O)C(=C1O)SC2=CC=CC=C2[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C18H15NO4S/c20-15-10-13(12-6-2-1-3-7-12)11-16(21)18(15)24-17-9-5-4-8-14(17)19(22)23/h1-9,13,20H,10-11H2/t13-/m0/s1