ethanol; (6Z)-6-[[[(2S)-4-methylsulfanyl-1-oxidanyl-butan-2-yl]amino]methylidene]cyclohexa-2,4-dien-1-one; oxidanylidenevanadium

Systemtic Name: ethanol; (6Z)-6-[[[(2S)-4-methylsulfanyl-1-oxidanyl-butan-2-yl]amino]methylidene]cyclohexa-2,4-dien-1-one; oxidanylidenevanadium Openeye Name: ethanol; (6Z)-6-[[[(1S)-1-(hydroxymethyl)-3-methylsulfanyl-propyl]amino]methylene]cyclohexa-2,4-dien-1-one; oxovanadium CAS Name: ethanol; (6Z)-6-[[[(2S)-1-hydroxy-4-(methylthio)butan-2-yl]amino]methylidene]-1-cyclohexa-2,4-dienone; oxovanadium IUPAC Name: ethanol; (6Z)-6-[[[(2S)-1-hydroxy-4-methylsulfanylbutan-2-yl]amino]methylidene]cyclohexa-2,4-dien-1-one; oxovanadium Traditional Name: ethanol; ketovanadium; (6Z)-6-[[[(1S)-1-methylol-3-(methylthio)propyl]amino]methylene]cyclohexa-2,4-dien-1-one Formula: C14H23NO4SV MolecularWeight: 352.34322

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Descriptors Computed from Structure

Canonical SMILES:

CCO.CSCCC(CO)NC=C1C=CC=CC1=O.O=[V]

Isomeric SMILES

CCO.CSCC[C@@H](CO)N/C=C\1/C=CC=CC1=O.O=[V]

InChI

InChI=1S/C12H17NO2S.C2H6O.O.V/c1-16-7-6-11(9-14)13-8-10-4-2-3-5-12(10)15;1-2-3;;/h2-5,8,11,13-14H,6-7,9H2,1H3;3H,2H2,1H3;;/b10-8-;;;/t11-;;;/m0.../s1