(2S)-2-(cyclohexylcarbonylamino)-3-(1H-imidazol-3-ium-5-yl)propanoate

Systemtic Name: (2S)-2-(cyclohexylcarbonylamino)-3-(1H-imidazol-3-ium-5-yl)propanoate Openeye Name: (2S)-2-(cyclohexanecarbonylamino)-3-(1H-imidazol-3-ium-5-yl)propanoate CAS Name: (2S)-2-[[cyclohexyl(oxo)methyl]amino]-3-(1H-imidazol-3-ium-5-yl)propanoate IUPAC Name: (2S)-2-(cyclohexanecarbonylamino)-3-(1H-imidazol-3-ium-5-yl)propanoate Traditional Name: (2S)-2-(cyclohexanecarbonylamino)-3-(1H-imidazol-3-ium-5-yl)propionate Formula: C13H19N3O3 MolecularWeight: 265.30826

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC(CC2=C[NH+]=CN2)C(=O)[O-]

Isomeric SMILES

C1CCC(CC1)C(=O)N[C@@H](CC2=C[NH+]=CN2)C(=O)[O-]

InChI

InChI=1S/C13H19N3O3/c17-12(9-4-2-1-3-5-9)16-11(13(18)19)6-10-7-14-8-15-10/h7-9,11H,1-6H2,(H,14,15)(H,16,17)(H,18,19)/t11-/m0/s1