2-[(1S,4E,8E,12Z)-12-hydroxyiminocyclododeca-4,8-dien-1-yl]sulfanylphenol

Systemtic Name: 2-[(1S,4E,8E,12Z)-12-hydroxyiminocyclododeca-4,8-dien-1-yl]sulfanylphenol Openeye Name: (4E,8E,12S)-12-(2-hydroxyphenyl)sulfanylcyclododeca-4,8-dien-1-one oxime CAS Name: (4E,8E,12S)-12-[(2-hydroxyphenyl)thio]-1-cyclododeca-4,8-dienone oxime IUPAC Name: 2-[(1S,4E,8E,12Z)-12-hydroxyiminocyclododeca-4,8-dien-1-yl]sulfanylphenol Traditional Name: (4E,8E,12S)-12-[(2-hydroxyphenyl)thio]cyclododeca-4,8-dien-1-one oxime Formula: C18H23NO2S MolecularWeight: 317.44572

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Descriptors Computed from Structure

Canonical SMILES:

C1CC=CCCC(=NO)C(CCC=C1)SC2=CC=CC=C2O

Isomeric SMILES

C\1C/C=C/CC/C(=N/O)/[C@H](CC/C=C1)SC2=CC=CC=C2O

InChI

InChI=1S/C18H23NO2S/c20-16-12-9-10-14-18(16)22-17-13-8-6-4-2-1-3-5-7-11-15(17)19-21/h3-6,9-10,12,14,17,20-21H,1-2,7-8,11,13H2/b5-3+,6-4+,19-15-/t17-/m0/s1