DBP
Summary
| Name: | 1,3-DIAMINOBENZYL PHENYLALANINE |
| Formula: | C7 H10 N2 |
| Formal charge: | 0 |
| Formula weight: | 122.168 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 3-(aminomethyl)aniline |
| OpenEye OEToolkits | 1.5.0 | 3-(aminomethyl)aniline |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | NCc1cc(N)ccc1 |
| SMILES_CANONICAL | CACTVS | 3.341 | NCc1cccc(N)c1 |
| SMILES | CACTVS | 3.341 | NCc1cccc(N)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cc(cc(c1)N)CN |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1cc(cc(c1)N)CN |
| InChI | InChI | 1.03 | InChI=1S/C7H10N2/c8-5-6-2-1-3-7(9)4-6/h1-4H,5,8-9H2 |
| InChIKey | InChI | 1.03 | ZDBWYUOUYNQZBM-UHFFFAOYSA-N |
