8P1
Summary
Name: | 6-azanyl-3,4-dihydro-2~{H}-naphthalen-1-one |
Formula: | C10 H11 N O |
Formal charge: | 0 |
Formula weight: | 161.2 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.6 | 6-azanyl-3,4-dihydro-2~{H}-naphthalen-1-one |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C10H11NO/c11-8-4-5-9-7(6-8)2-1-3-10(9)12/h4-6H,1-3,11H2 |
InChIKey | InChI | 1.03 | BEVVUJBVEXJGKM-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Nc1ccc2C(=O)CCCc2c1 |
SMILES | CACTVS | 3.385 | Nc1ccc2C(=O)CCCc2c1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1cc2c(cc1N)CCCC2=O |
SMILES | OpenEye OEToolkits | 2.0.6 | c1cc2c(cc1N)CCCC2=O |