6-azanyl-2-(3-imidazol-1-ylpropyl)hexanoic acid

Systemtic Name: 6-azanyl-2-(3-imidazol-1-ylpropyl)hexanoic acid Openeye Name: 6-amino-2-(3-imidazol-1-ylpropyl)hexanoic acid CAS Name: 6-amino-2-[3-(1-imidazolyl)propyl]hexanoic acid IUPAC Name: 6-amino-2-(3-imidazol-1-ylpropyl)hexanoic acid Traditional Name: 6-amino-2-(3-imidazol-1-ylpropyl)hexanoic acid Formula: C12H21N3O2 MolecularWeight: 239.31404

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=N1)CCCC(CCCCN)C(=O)O

Isomeric SMILES

C1=CN(C=N1)CCCC(CCCCN)C(=O)O

InChI

InChI=1S/C12H21N3O2/c13-6-2-1-4-11(12(16)17)5-3-8-15-9-7-14-10-15/h7,9-11H,1-6,8,13H2,(H,16,17)