A1CP6
Summary
| Name: | methyl (3-methylphenyl)carbamate |
| Formula: | C9 H11 N O2 |
| Formal charge: | 0 |
| Formula weight: | 165.189 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 14.52 | methyl (3-methylphenyl)carbamate |
| OpenEye OEToolkits | 3.1.0.0 | methyl ~{N}-(3-methylphenyl)carbamate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | O=C(OC)Nc1cc(C)ccc1 |
| InChI | InChI | 1.06 | InChI=1S/C9H11NO2/c1-7-4-3-5-8(6-7)10-9(11)12-2/h3-6H,1-2H3,(H,10,11) |
| InChIKey | InChI | 1.06 | YYKXNDIQHDVJKF-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COC(=O)Nc1cccc(C)c1 |
| SMILES | CACTVS | 3.385 | COC(=O)Nc1cccc(C)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | Cc1cccc(c1)NC(=O)OC |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | Cc1cccc(c1)NC(=O)OC |
