Basic Information |
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Product Name: | BENZOIC ACID, 2-[(3R)-3-[[[1-(CARBOXYMETHYL)CYCLOPROPYL]METHYL]THIO]-3-[3-[(1E)-2-(7-CHLORO-2-QUINOLINYL)ETHENYL]PHENYL]PROPYL]-, 1-METHYL ESTER |
CAS: | 851755-56-1 |
English Synonyms: | BENZOIC ACID, 2-[(3R)-3-[[[1-(CARBOXYMETHYL)CYCLOPROPYL]METHYL]THIO]-3-[3-[(1E)-2-(7-CHLORO-2-QUINOLINYL)ETHENYL]PHENYL]PROPYL]-, 1-METHYL ESTER |
MDL Number.: | MFCD23380775 |
H bond acceptor: | 5 |
H bond donor: | 1 |
Smile: | COC(=O)c1ccccc1CC[C@H](c2cccc(c2)/C=C/c3ccc4ccc(cc4n3)Cl)SCC5(CC5)CC(=O)O |
InChi: | InChI=1S/C34H32ClNO4S/c1-40-33(39)29-8-3-2-6-24(29)12-16-31(41-22-34(17-18-34)21-32(37)38)26-7-4-5-23(19-26)9-14-28-15-11-25-10-13-27(35)20-30(25)36-28/h2-11,13-15,19-20,31H,12,16-18,21-22H2,1H3,(H,37,38)/b14-9+/t31-/m1/s1 |
InChiKey: | InChIKey=FVMXWBDOMBDOJN-JLBZDQGGSA-N |
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