PB2
Summary
| Name: | 1-(biphenyl-4-ylmethyl)-1H-imidazole |
| Formula: | C16 H14 N2 |
| Formal charge: | 0 |
| Formula weight: | 234.296 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 1-(biphenyl-4-ylmethyl)-1H-imidazole |
| OpenEye OEToolkits | 1.5.0 | 1-[(4-phenylphenyl)methyl]imidazole |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | n1ccn(c1)Cc3ccc(c2ccccc2)cc3 |
| SMILES_CANONICAL | CACTVS | 3.341 | C(n1ccnc1)c2ccc(cc2)c3ccccc3 |
| SMILES | CACTVS | 3.341 | C(n1ccnc1)c2ccc(cc2)c3ccccc3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)c2ccc(cc2)Cn3ccnc3 |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)c2ccc(cc2)Cn3ccnc3 |
| InChI | InChI | 1.03 | InChI=1S/C16H14N2/c1-2-4-15(5-3-1)16-8-6-14(7-9-16)12-18-11-10-17-13-18/h1-11,13H,12H2 |
| InChIKey | InChI | 1.03 | DLYMRVCQTVOYEW-UHFFFAOYSA-N |
