TRY
Summary
| Name: | (2Z)-2-amino-3-(1H-indol-3-yl)prop-2-enoic acid |
| Formula: | C11 H10 N2 O2 |
| Formal charge: | 0 |
| Formula weight: | 202.209 Da |
| Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (2Z)-2-amino-3-(1H-indol-3-yl)prop-2-enoic acid |
| OpenEye OEToolkits | 1.7.2 | (Z)-2-azanyl-3-(1H-indol-3-yl)prop-2-enoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)/C(N)=C/c2c1ccccc1nc2 |
| SMILES_CANONICAL | CACTVS | 3.370 | N\C(=C/c1c[nH]c2ccccc12)C(O)=O |
| SMILES | CACTVS | 3.370 | NC(=Cc1c[nH]c2ccccc12)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.2 | c1ccc2c(c1)c(c[nH]2)/C=C(/C(=O)O)\N |
| SMILES | OpenEye OEToolkits | 1.7.2 | c1ccc2c(c1)c(c[nH]2)C=C(C(=O)O)N |
| InChI | InChI | 1.03 | InChI=1S/C11H10N2O2/c12-9(11(14)15)5-7-6-13-10-4-2-1-3-8(7)10/h1-6,13H,12H2,(H,14,15)/b9-5- |
| InChIKey | InChI | 1.03 | HXAJMKJPBQFASJ-UITAMQMPSA-N |
