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2-[(6-chloranyl-1,3-benzodioxol-5-yl)methylsulfanyl-(methylamino)methylidene]cyclohexane-1,3-dione

2-[(6-chloranyl-1,3-benzodioxol-5-yl)methylsulfanyl-(methylamino)methylidene]cyclohexane-1,3-dione

Systemtic Name:2-[(6-chloranyl-1,3-benzodioxol-5-yl)methylsulfanyl-(methylamino)methylidene]cyclohexane-1,3-dione
Openeye Name:2-[(6-chloro-1,3-benzodioxol-5-yl)methylsulfanyl-(methylamino)methylene]cyclohexane-1,3-dione
CAS Name:2-[[(6-chloro-1,3-benzodioxol-5-yl)methylthio]-(methylamino)methylidene]cyclohexane-1,3-dione
IUPAC Name:2-[(6-chloro-1,3-benzodioxol-5-yl)methylsulfanyl-(methylamino)methylidene]cyclohexane-1,3-dione
Traditional Name:2-[[(6-chloro-1,3-benzodioxol-5-yl)methylthio]-(methylamino)methylene]cyclohexane-1,3-quinone
Formula: C16H16ClNO4S
MolecularWeight: 353.82054
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Descriptors Computed from Structure

Canonical SMILES:

CNC(=C1C(=O)CCCC1=O)SCC2=CC3=C(C=C2Cl)OCO3


Isomeric SMILES

CNC(=C1C(=O)CCCC1=O)SCC2=CC3=C(C=C2Cl)OCO3


InChI

InChI=1S/C16H16ClNO4S/c1-18-16(15-11(19)3-2-4-12(15)20)23-7-9-5-13-14(6-10(9)17)22-8-21-13/h5-6,18H,2-4,7-8H2,1H3


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