NT7
Summary
Name: | N-(2,3-dimethylphenyl)-2-(morpholin-4-yl)acetamide |
Formula: | C14 H20 N2 O2 |
Formal charge: | 0 |
Formula weight: | 248.321 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | N-(2,3-dimethylphenyl)-2-(morpholin-4-yl)acetamide |
OpenEye OEToolkits | 2.0.6 | ~{N}-(2,3-dimethylphenyl)-2-morpholin-4-yl-ethanamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | N(C(=O)CN1CCOCC1)c2cccc(c2C)C |
InChI | InChI | 1.03 | InChI=1S/C14H20N2O2/c1-11-4-3-5-13(12(11)2)15-14(17)10-16-6-8-18-9-7-16/h3-5H,6-10H2,1-2H3,(H,15,17) |
InChIKey | InChI | 1.03 | PPTFUQPLPCCALB-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Cc1cccc(NC(=O)CN2CCOCC2)c1C |
SMILES | CACTVS | 3.385 | Cc1cccc(NC(=O)CN2CCOCC2)c1C |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | Cc1cccc(c1C)NC(=O)CN2CCOCC2 |
SMILES | OpenEye OEToolkits | 2.0.6 | Cc1cccc(c1C)NC(=O)CN2CCOCC2 |