VOE
Summary
Name: | (2R)-2-phenylbutan-1-amine |
Formula: | C10 H15 N |
Formal charge: | 0 |
Formula weight: | 149.233 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | (2R)-2-phenylbutan-1-amine |
OpenEye OEToolkits | 2.0.7 | (2~{R})-2-phenylbutan-1-amine |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | NCC(CC)c1ccccc1 |
InChI | InChI | 1.06 | InChI=1S/C10H15N/c1-2-9(8-11)10-6-4-3-5-7-10/h3-7,9H,2,8,11H2,1H3/t9-/m0/s1 |
InChIKey | InChI | 1.06 | PLWALTDUYKDGRF-VIFPVBQESA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CC[C@@H](CN)c1ccccc1 |
SMILES | CACTVS | 3.385 | CC[CH](CN)c1ccccc1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC[C@@H](CN)c1ccccc1 |
SMILES | OpenEye OEToolkits | 2.0.7 | CCC(CN)c1ccccc1 |