2-[(2R,3S)-3,4-bis(oxidanyl)-1-phenylsulfanyl-butan-2-yl]isoindole-1,3-dione

Systemtic Name: 2-[(2R,3S)-3,4-bis(oxidanyl)-1-phenylsulfanyl-butan-2-yl]isoindole-1,3-dione Openeye Name: 2-[(1R,2S)-2,3-dihydroxy-1-(phenylsulfanylmethyl)propyl]isoindoline-1,3-dione CAS Name: 2-[(2R,3S)-3,4-dihydroxy-1-(phenylthio)butan-2-yl]isoindole-1,3-dione IUPAC Name: 2-[(2R,3S)-3,4-dihydroxy-1-phenylsulfanylbutan-2-yl]isoindole-1,3-dione Traditional Name: 2-[(1R,2S)-2,3-dihydroxy-1-[(phenylthio)methyl]propyl]isoindoline-1,3-quinone Formula: C18H17NO4S MolecularWeight: 343.39688

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCC(C(CO)O)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

C1=CC=C(C=C1)SC[C@@H]([C@@H](CO)O)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C18H17NO4S/c20-10-16(21)15(11-24-12-6-2-1-3-7-12)19-17(22)13-8-4-5-9-14(13)18(19)23/h1-9,15-16,20-21H,10-11H2/t15-,16+/m0/s1