LUU
Summary
Name: | 1~{H}-indol-5-ylmethanamine |
Formula: | C9 H10 N2 |
Formal charge: | 0 |
Formula weight: | 146.189 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | 1~{H}-indol-5-ylmethanamine |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.06 | InChI=1S/C9H10N2/c10-6-7-1-2-9-8(5-7)3-4-11-9/h1-5,11H,6,10H2 |
InChIKey | InChI | 1.06 | UAYYSAPJTRVEQA-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | NCc1ccc2[nH]ccc2c1 |
SMILES | CACTVS | 3.385 | NCc1ccc2[nH]ccc2c1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc2c(cc[nH]2)cc1CN |
SMILES | OpenEye OEToolkits | 2.0.7 | c1cc2c(cc[nH]2)cc1CN |