Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=C(O)CN(N)C(=O)CCC(=O)N(Cc1ccccc1)C |
SMILES_CANONICAL | CACTVS | 3.341 | CN(Cc1ccccc1)C(=O)CCC(=O)N(N)CC(O)=O |
SMILES | CACTVS | 3.341 | CN(Cc1ccccc1)C(=O)CCC(=O)N(N)CC(O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CN(Cc1ccccc1)C(=O)CCC(=O)N(CC(=O)O)N |
SMILES | OpenEye OEToolkits | 1.5.0 | CN(Cc1ccccc1)C(=O)CCC(=O)N(CC(=O)O)N |
InChI | InChI | 1.03 | InChI=1S/C14H19N3O4/c1-16(9-11-5-3-2-4-6-11)12(18)7-8-13(19)17(15)10-14(20)21/h2-6H,7-10,15H2,1H3,(H,20,21) |
InChIKey | InChI | 1.03 | WPWZLRZWAPNRKX-UHFFFAOYSA-N |