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Summary
Name: | 4-(aminomethyl)benzenecarboximidamide |
Formula: | C8 H11 N3 |
Formal charge: | 0 |
Formula weight: | 149.193 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | 4-(aminomethyl)benzenecarboximidamide |
OpenEye OEToolkits | 1.7.0 | 4-(aminomethyl)benzenecarboximidamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | [N@H]=C(c1ccc(cc1)CN)N |
SMILES_CANONICAL | CACTVS | 3.370 | NCc1ccc(cc1)C(N)=N |
SMILES | CACTVS | 3.370 | NCc1ccc(cc1)C(N)=N |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | [H]/N=C(/c1ccc(cc1)CN)\N |
SMILES | OpenEye OEToolkits | 1.7.0 | c1cc(ccc1CN)C(=N)N |
InChI | InChI | 1.03 | InChI=1S/C8H11N3/c9-5-6-1-3-7(4-2-6)8(10)11/h1-4H,5,9H2,(H3,10,11) |
InChIKey | InChI | 1.03 | CHOGNBXWAZDZBM-UHFFFAOYSA-N |