| PDB CCD ID: | MX3 |
| Number of entries in BioLiP: | 0 |
| Chemical formula: | C14 H19 N3 O4 |
| InChI: | 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: | WPWZLRZWAPNRKX-UHFFFAOYSA-N |
| SMILES: | | Software | SMILES |
|---|
| CACTVS 3.341 | CN(Cc1ccccc1)C(=O)CCC(=O)N(N)CC(O)=O | | OpenEye OEToolkits 1.5.0 | CN(Cc1ccccc1)C(=O)CCC(=O)N(CC(=O)O)N | | ACDLabs 10.04 | O=C(O)CN(N)C(=O)CCC(=O)N(Cc1ccccc1)C |
|
| Name: | (1-{4-[BENZYL(METHYL)AMINO]-4-OXOBUTANOYL}HYDRAZINO)ACETIC ACID;
AZA-ASPARTATE-N-BENZYL-N-METHYL-ACRYLAMIDE |
| ZINC: | ZINC000058650025 |
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