basic_info |
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| Product_Name: | BENZENEPROPANOIC ACID, 3-CYANO-4-[(2R)-3-[[1,1-DIMETHYL-2-(2-NAPHTHALENYL)ETHYL]AMINO]-2-HYDROXYPROPOXY]-, ETHYL ESTER, (HYDROCHLORIDE) (1:1) |
| CAS: | 1192845-62-7 |
| EnglishSynonyms: | BENZENEPROPANOIC ACID, 3-CYANO-4-[(2R)-3-[[1,1-DIMETHYL-2-(2-NAPHTHALENYL)ETHYL]AMINO]-2-HYDROXYPROPOXY]-, ETHYL ESTER, (HYDROCHLORIDE) (1:1) |
| pro_mdlNumber: | MFCD18782682 |
| pro_acceptors: | 6 |
| pro_donors: | 2 |
| pro_smile: | CCOC(=O)CCc1ccc(c(c1)C#N)OC[C@@H](CNC(C)(C)Cc2ccc3ccccc3c2)O.Cl |
| InChi: | InChI=1S/C29H34N2O4.ClH/c1-4-34-28(33)14-11-21-10-13-27(25(15-21)18-30)35-20-26(32)19-31-29(2,3)17-22-9-12-23-7-5-6-8-24(23)16-22;/h5-10,12-13,15-16,26,31-32H,4,11,14,17,19-20H2,1-3H3;1H/t26-;/m1./s1 |
| InChiKey: | InChIKey=IFWPZKFWNGLFCD-UFTMZEDQSA-N |
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