P6N
Summary
Name: | (2~{S})-2-methyl-3,4-dihydro-2~{H}-naphthalen-1-one |
Formula: | C11 H12 O |
Formal charge: | 0 |
Formula weight: | 160.212 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | (2~{S})-2-methyl-3,4-dihydro-2~{H}-naphthalen-1-one |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C11H12O/c1-8-6-7-9-4-2-3-5-10(9)11(8)12/h2-5,8H,6-7H2,1H3/t8-/m0/s1 |
InChIKey | InChI | 1.03 | GANIBVZSZGNMNB-QMMMGPOBSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | C[C@H]1CCc2ccccc2C1=O |
SMILES | CACTVS | 3.385 | C[CH]1CCc2ccccc2C1=O |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C[C@H]1CCc2ccccc2C1=O |
SMILES | OpenEye OEToolkits | 2.0.7 | CC1CCc2ccccc2C1=O |