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

Systemtic Name: (2S)-2-(cyclopentylcarbonylamino)-3-(1H-imidazol-3-ium-5-yl)propanoate Openeye Name: (2S)-2-(cyclopentanecarbonylamino)-3-(1H-imidazol-3-ium-5-yl)propanoate CAS Name: (2S)-2-[[cyclopentyl(oxo)methyl]amino]-3-(1H-imidazol-3-ium-5-yl)propanoate IUPAC Name: (2S)-2-(cyclopentanecarbonylamino)-3-(1H-imidazol-3-ium-5-yl)propanoate Traditional Name: (2S)-2-(cyclopentanecarbonylamino)-3-(1H-imidazol-3-ium-5-yl)propionate Formula: C12H17N3O3 MolecularWeight: 251.28168

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(=O)NC(CC2=C[NH+]=CN2)C(=O)[O-]

Isomeric SMILES

C1CCC(C1)C(=O)N[C@@H](CC2=C[NH+]=CN2)C(=O)[O-]

InChI

InChI=1S/C12H17N3O3/c16-11(8-3-1-2-4-8)15-10(12(17)18)5-9-6-13-7-14-9/h6-8,10H,1-5H2,(H,13,14)(H,15,16)(H,17,18)/t10-/m0/s1