2-(4-azaniumylbutanoylamino)-3-(1H-imidazol-5-yl)propanoate

Systemtic Name: 2-(4-azaniumylbutanoylamino)-3-(1H-imidazol-5-yl)propanoate Openeye Name: 2-(4-azaniumylbutanoylamino)-3-(1H-imidazol-5-yl)propanoate CAS Name: 2-[(4-ammonio-1-oxobutyl)amino]-3-(1H-imidazol-5-yl)propanoate IUPAC Name: 2-(4-azaniumylbutanoylamino)-3-(1H-imidazol-5-yl)propanoate Traditional Name: 2-(4-ammoniobutanoylamino)-3-(1H-imidazol-5-yl)propionate Formula: C10H16N4O3 MolecularWeight: 240.25904

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H16N4O3/c11-3-1-2-9(15)14-8(10(16)17)4-7-5-12-6-13-7/h5-6,8H,1-4,11H2,(H,12,13)(H,14,15)(H,16,17)