HAN
Summary
| Name: | 2-AMINO-5,6-DIMETHYL-BENZIMIDAZOLE-1-PENTANOIC ACID |
| Formula: | C14 H19 N3 O2 |
| Formal charge: | 0 |
| Formula weight: | 261.32 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 5-(2-amino-5,6-dimethyl-1H-benzimidazol-1-yl)pentanoic acid |
| OpenEye OEToolkits | 1.5.0 | 5-(2-amino-5,6-dimethyl-benzimidazol-1-yl)pentanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)CCCCn1c2cc(c(cc2nc1N)C)C |
| SMILES_CANONICAL | CACTVS | 3.341 | Cc1cc2nc(N)n(CCCCC(O)=O)c2cc1C |
| SMILES | CACTVS | 3.341 | Cc1cc2nc(N)n(CCCCC(O)=O)c2cc1C |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | Cc1cc2c(cc1C)n(c(n2)N)CCCCC(=O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | Cc1cc2c(cc1C)n(c(n2)N)CCCCC(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C14H19N3O2/c1-9-7-11-12(8-10(9)2)17(14(15)16-11)6-4-3-5-13(18)19/h7-8H,3-6H2,1-2H3,(H2,15,16)(H,18,19) |
| InChIKey | InChI | 1.03 | ONFQTORHROMJSV-UHFFFAOYSA-N |
