NC4
Summary
| Name: | 4-{[(CYCLOHEXYLAMINO)CARBONYL]AMINO}BUTANOIC ACID |
| Synonyms: | 4-(3-CYCLOHEXYLURIEDO)-BUTYRIC ACID |
| Formula: | C11 H20 N2 O3 |
| Formal charge: | 0 |
| Formula weight: | 228.288 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 4-[(cyclohexylcarbamoyl)amino]butanoic acid |
| OpenEye OEToolkits | 1.5.0 | 4-(cyclohexylcarbamoylamino)butanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(NC1CCCCC1)NCCCC(=O)O |
| SMILES_CANONICAL | CACTVS | 3.341 | OC(=O)CCCNC(=O)NC1CCCCC1 |
| SMILES | CACTVS | 3.341 | OC(=O)CCCNC(=O)NC1CCCCC1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C1CCC(CC1)NC(=O)NCCCC(=O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | C1CCC(CC1)NC(=O)NCCCC(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C11H20N2O3/c14-10(15)7-4-8-12-11(16)13-9-5-2-1-3-6-9/h9H,1-8H2,(H,14,15)(H2,12,13,16) |
| InChIKey | InChI | 1.03 | WSVFRGGLURJIMG-UHFFFAOYSA-N |
