9XG
Summary
| Name: | 3-methyl-N-phenylaniline |
| Formula: | C13 H13 N |
| Formal charge: | 0 |
| Formula weight: | 183.249 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 3-methyl-N-phenylaniline |
| OpenEye OEToolkits | 2.0.6 | 3-methyl-~{N}-phenyl-aniline |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Cc1cccc(c1)Nc2ccccc2 |
| InChI | InChI | 1.03 | InChI=1S/C13H13N/c1-11-6-5-9-13(10-11)14-12-7-3-2-4-8-12/h2-10,14H,1H3 |
| InChIKey | InChI | 1.03 | TWPMMLHBHPYSMT-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1cccc(Nc2ccccc2)c1 |
| SMILES | CACTVS | 3.385 | Cc1cccc(Nc2ccccc2)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | Cc1cccc(c1)Nc2ccccc2 |
| SMILES | OpenEye OEToolkits | 2.0.6 | Cc1cccc(c1)Nc2ccccc2 |
