5-CHLORO-2-[[[[(4-NITROPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID

pro_cas
535966-10-0
pro_cdbregno
CCD00397103
pro_formula
C16 H12 Cl N3 O6 S
pro_molWeight
409.805

basic_info

Product_Name: 5-CHLORO-2-[[[[(4-NITROPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
CAS: 535966-10-0
EnglishSynonyms: BENZOIC ACID, 5-CHLORO-2-[[[[(4-NITROPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]- ; 5-CHLORO-2-[[[[(4-NITROPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
pro_mdlNumber: MFCD03572872
pro_acceptors: 9
pro_donors: 3
pro_smile: c1cc(ccc1[N+](=O)[O-])OCC(=O)NC(=S)Nc2ccc(cc2C(=O)O)Cl
InChi: InChI=1S/C16H12ClN3O6S/c17-9-1-6-13(12(7-9)15(22)23)18-16(27)19-14(21)8-26-11-4-2-10(3-5-11)20(24)25/h1-7H,8H2,(H,22,23)(H2,18,19,21,27)
InChiKey: InChIKey=JDXXMGFLDMHGDV-UHFFFAOYSA-N

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