(6Z)-6-[[[(2S,3S)-3-methyl-1-oxidanyl-pentan-2-yl]amino]methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: (6Z)-6-[[[(2S,3S)-3-methyl-1-oxidanyl-pentan-2-yl]amino]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6Z)-6-[[[(1S,2S)-1-(hydroxymethyl)-2-methyl-butyl]amino]methylene]cyclohexa-2,4-dien-1-one CAS Name: (6Z)-6-[[[(2S,3S)-1-hydroxy-3-methylpentan-2-yl]amino]methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6Z)-6-[[[(2S,3S)-1-hydroxy-3-methylpentan-2-yl]amino]methylidene]cyclohexa-2,4-dien-1-one Traditional Name: (6Z)-6-[[[(1S,2S)-2-methyl-1-methylol-butyl]amino]methylene]cyclohexa-2,4-dien-1-one Formula: C13H19NO2 MolecularWeight: 221.29546

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(CO)NC=C1C=CC=CC1=O

Isomeric SMILES

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

InChI

InChI=1S/C13H19NO2/c1-3-10(2)12(9-15)14-8-11-6-4-5-7-13(11)16/h4-8,10,12,14-15H,3,9H2,1-2H3/b11-8-/t10-,12+/m0/s1