A1BTF
Summary
| Name: | 4-methyl-N~1~-(2-methylphenyl)benzene-1,3-dicarboxamide |
| Formula: | C16 H16 N2 O2 |
| Formal charge: | 0 |
| Formula weight: | 268.31 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 14.52 | 4-methyl-N~1~-(2-methylphenyl)benzene-1,3-dicarboxamide |
| OpenEye OEToolkits | 3.1.0.0 | 4-methyl-~{N}1-(2-methylphenyl)benzene-1,3-dicarboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | O=C(Nc1ccccc1C)c1ccc(C)c(c1)C(N)=O |
| InChI | InChI | 1.06 | InChI=1S/C16H16N2O2/c1-10-7-8-12(9-13(10)15(17)19)16(20)18-14-6-4-3-5-11(14)2/h3-9H,1-2H3,(H2,17,19)(H,18,20) |
| InChIKey | InChI | 1.06 | MQPWOZBWSFDFOW-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1ccccc1NC(=O)c2ccc(C)c(c2)C(N)=O |
| SMILES | CACTVS | 3.385 | Cc1ccccc1NC(=O)c2ccc(C)c(c2)C(N)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | Cc1ccccc1NC(=O)c2ccc(c(c2)C(=O)N)C |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | Cc1ccccc1NC(=O)c2ccc(c(c2)C(=O)N)C |
