DH6
Summary
Name: | CINNAMIDE |
Formula: | C9 H9 N O |
Formal charge: | 0 |
Formula weight: | 147.174 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 1.7.6 | (E)-3-phenylprop-2-enamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C9H9NO/c10-9(11)7-6-8-4-2-1-3-5-8/h1-7H,(H2,10,11)/b7-6+ |
InChIKey | InChI | 1.03 | APEJMQOBVMLION-VOTSOKGWSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | NC(=O)\C=C\c1ccccc1 |
SMILES | CACTVS | 3.385 | NC(=O)C=Cc1ccccc1 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1ccc(cc1)/C=C/C(=O)N |
SMILES | OpenEye OEToolkits | 1.7.6 | c1ccc(cc1)C=CC(=O)N |