UID
Summary
Name: | ethyl (E)-3-(4-aminophenyl)prop-2-enoate |
Formula: | C11 H13 N O2 |
Formal charge: | 0 |
Formula weight: | 191.226 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | ethyl (~{E})-3-(4-aminophenyl)prop-2-enoate |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.06 | InChI=1S/C11H13NO2/c1-2-14-11(13)8-5-9-3-6-10(12)7-4-9/h3-8H,2,12H2,1H3/b8-5+ |
InChIKey | InChI | 1.06 | NRPMBSHHBFFYBF-VMPITWQZSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CCOC(=O)\C=C\c1ccc(N)cc1 |
SMILES | CACTVS | 3.385 | CCOC(=O)C=Cc1ccc(N)cc1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCOC(=O)/C=C/c1ccc(cc1)N |
SMILES | OpenEye OEToolkits | 2.0.7 | CCOC(=O)C=Cc1ccc(cc1)N |