2-(2-azaniumylethanoylamino)-3-(1H-imidazol-5-yl)propanoate

Systemtic Name: 2-(2-azaniumylethanoylamino)-3-(1H-imidazol-5-yl)propanoate Openeye Name: 2-[(2-azaniumylacetyl)amino]-3-(1H-imidazol-5-yl)propanoate CAS Name: 2-[(2-ammonio-1-oxoethyl)amino]-3-(1H-imidazol-5-yl)propanoate IUPAC Name: 2-[(2-azaniumylacetyl)amino]-3-(1H-imidazol-5-yl)propanoate Traditional Name: 2-[(2-ammonioacetyl)amino]-3-(1H-imidazol-5-yl)propionate Formula: C8H12N4O3 MolecularWeight: 212.20588

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(NC=N1)CC(C(=O)[O-])NC(=O)C[NH3+]

Isomeric SMILES

C1=C(NC=N1)CC(C(=O)[O-])NC(=O)C[NH3+]

InChI

InChI=1S/C8H12N4O3/c9-2-7(13)12-6(8(14)15)1-5-3-10-4-11-5/h3-4,6H,1-2,9H2,(H,10,11)(H,12,13)(H,14,15)