SYG
Summary
Name: | 2-[(1~{S})-1-azanylpropyl]phenol |
Formula: | C9 H13 N O |
Formal charge: | 0 |
Formula weight: | 151.206 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.6 | 2-[(1~{S})-1-azanylpropyl]phenol |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C9H13NO/c1-2-8(10)7-5-3-4-6-9(7)11/h3-6,8,11H,2,10H2,1H3/t8-/m0/s1 |
InChIKey | InChI | 1.03 | SJYRIEHMQRIBEN-QMMMGPOBSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CC[C@H](N)c1ccccc1O |
SMILES | CACTVS | 3.385 | CC[CH](N)c1ccccc1O |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CC[C@@H](c1ccccc1O)N |
SMILES | OpenEye OEToolkits | 2.0.6 | CCC(c1ccccc1O)N |