A1ATL
Summary
| Name: | losartan carboxylic acid |
| Synonyms: | 2-butyl-4-chloro-1-{[(2'M)-2'-(1H-tetrazol-5-yl)[1,1'-biphenyl]-4-yl]methyl}-1H-imidazole-5-carboxylic acid EXP3174; E-3174 |
| Formula: | C22 H21 Cl N6 O2 |
| Formal charge: | 0 |
| Formula weight: | 436.894 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 2-butyl-4-chloro-1-{[(2'M)-2'-(1H-tetrazol-5-yl)[1,1'-biphenyl]-4-yl]methyl}-1H-imidazole-5-carboxylic acid |
| OpenEye OEToolkits | 2.0.7 | 2-butyl-5-chloranyl-3-[[4-[2-(1~{H}-1,2,3,4-tetrazol-5-yl)phenyl]phenyl]methyl]imidazole-4-carboxylic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)c1c(Cl)nc(CCCC)n1Cc1ccc(cc1)c1ccccc1c1nnn[NH]1 |
| InChI | InChI | 1.06 | InChI=1S/C22H21ClN6O2/c1-2-3-8-18-24-20(23)19(22(30)31)29(18)13-14-9-11-15(12-10-14)16-6-4-5-7-17(16)21-25-27-28-26-21/h4-7,9-12H,2-3,8,13H2,1H3,(H,30,31)(H,25,26,27,28) |
| InChIKey | InChI | 1.06 | ZEUXAIYYDDCIRX-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCCCc1nc(Cl)c(n1Cc2ccc(cc2)c3ccccc3c4[nH]nnn4)C(O)=O |
| SMILES | CACTVS | 3.385 | CCCCc1nc(Cl)c(n1Cc2ccc(cc2)c3ccccc3c4[nH]nnn4)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCCCc1nc(c(n1Cc2ccc(cc2)c3ccccc3c4[nH]nnn4)C(=O)O)Cl |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCCCc1nc(c(n1Cc2ccc(cc2)c3ccccc3c4[nH]nnn4)C(=O)O)Cl |
