CISMADINONE ,54063-31-9 _Chemical Cloud Database

CISMADINONE

Basic Information
Product Name：	CISMADINONE
CAS：	54063-31-9
English Synonyms：	CISMADINONE
MDL Number.：	MFCD00869005
H bond acceptor：	3
H bond donor：	1
Smile：	CC(=O)[C@]1(CCC2[C@@]1(CCC3C2C[C@@H](C4=CC(=O)C=C[C@]34C)Cl)C)O
InChi：	InChI=1S/C21H27ClO3/c1-12(23)21(25)9-6-16-14-11-18(22)17-10-13(24)4-7-19(17,2)15(14)5-8-20(16,21)3/h4,7,10,14-16,18,25H,5-6,8-9,11H2,1-3H3/t14?,15?,16?,18-,19+,20-,21-/m0/s1
InChiKey：	InChIKey=RNSISAJHBSCDGC-MNPPMKLISA-N

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