PTW
Summary
Name: | 1,3,5-triaza-7-phosphatricyclo[3.3.1.1~3,7~]decane |
Synonyms: | 1,3,5-Triaza-7-phosphaadamantane |
Formula: | C6 H12 N3 P |
Formal charge: | 0 |
Formula weight: | 157.153 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | 1,3,5-triaza-7-phosphatricyclo[3.3.1.1~3,7~]decane |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | N13CN2CN(CP(C1)C2)C3 |
SMILES_CANONICAL | CACTVS | 3.370 | C1N2CN3CN1CP(C2)C3 |
SMILES | CACTVS | 3.370 | C1N2CN3CN1CP(C2)C3 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | C1N2CN3CN1CP(C2)C3 |
SMILES | OpenEye OEToolkits | 1.7.0 | C1N2CN3CN1CP(C2)C3 |
InChI | InChI | 1.03 | InChI=1S/C6H12N3P/c1-7-2-9-3-8(1)5-10(4-7)6-9/h1-6H2 |
InChIKey | InChI | 1.03 | FXXRPTKTLVHPAR-UHFFFAOYSA-N |