5,5-DIMETHYL-2-((2-NITROPHENYL)THIO)-3-OXO-1-CYCLOHEXEN-1-YL 2-CHLOROBENZOATE

pro_cas
pro_cdbregno
CCD00171815
pro_formula
C21 H18 Cl N O5 S
pro_molWeight
431.894

basic_info

Product_Name: 5,5-DIMETHYL-2-((2-NITROPHENYL)THIO)-3-OXO-1-CYCLOHEXEN-1-YL 2-CHLOROBENZOATE
EnglishSynonyms: 5,5-DIMETHYL-2-((2-NITROPHENYL)THIO)-3-OXO-1-CYCLOHEXEN-1-YL 2-CHLOROBENZOATE
pro_mdlNumber: MFCD00839148
pro_acceptors: 6
pro_donors: 0
pro_smile: CC1(CC(=C(C(=O)C1)Sc2ccccc2[N+](=O)[O-])OC(=O)c3ccccc3Cl)C
InChi: InChI=1S/C21H18ClNO5S/c1-21(2)11-16(24)19(29-18-10-6-5-9-15(18)23(26)27)17(12-21)28-20(25)13-7-3-4-8-14(13)22/h3-10H,11-12H2,1-2H3
InChiKey: InChIKey=IMLOGDONUFNSQY-UHFFFAOYSA-N

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