6-(4,5-dihydro-1H-imidazol-3-ium-2-ylamino)hexanoate

Systemtic Name: 6-(4,5-dihydro-1H-imidazol-3-ium-2-ylamino)hexanoate Openeye Name: 6-(4,5-dihydro-1H-imidazol-3-ium-2-ylamino)hexanoate CAS Name: 6-(4,5-dihydro-1H-imidazol-3-ium-2-ylamino)hexanoate IUPAC Name: 6-(4,5-dihydro-1H-imidazol-3-ium-2-ylamino)hexanoate Traditional Name: 6-(2-imidazolin-1-ium-2-ylamino)hexanoate Formula: C9H17N3O2 MolecularWeight: 199.25018

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+]=C(N1)NCCCCCC(=O)[O-]

Isomeric SMILES

C1C[NH+]=C(N1)NCCCCCC(=O)[O-]

InChI

InChI=1S/C9H17N3O2/c13-8(14)4-2-1-3-5-10-9-11-6-7-12-9/h1-7H2,(H,13,14)(H2,10,11,12)