(2S)-2-(3-azaniumylpropanoylamino)-3-(3-methylimidazol-4-yl)propanoate

Systemtic Name: (2S)-2-(3-azaniumylpropanoylamino)-3-(3-methylimidazol-4-yl)propanoate Openeye Name: (2S)-2-(3-azaniumylpropanoylamino)-3-(3-methylimidazol-4-yl)propanoate CAS Name: (2S)-2-[(3-ammonio-1-oxopropyl)amino]-3-(3-methyl-4-imidazolyl)propanoate IUPAC Name: (2S)-2-(3-azaniumylpropanoylamino)-3-(3-methylimidazol-4-yl)propanoate Traditional Name: (2S)-2-(3-ammoniopropanoylamino)-3-(3-methylimidazol-4-yl)propionate Formula: C10H16N4O3 MolecularWeight: 240.25904

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC=C1CC(C(=O)[O-])NC(=O)CC[NH3+]

Isomeric SMILES

CN1C=NC=C1C[C@@H](C(=O)[O-])NC(=O)CC[NH3+]

InChI

InChI=1S/C10H16N4O3/c1-14-6-12-5-7(14)4-8(10(16)17)13-9(15)2-3-11/h5-6,8H,2-4,11H2,1H3,(H,13,15)(H,16,17)/t8-/m0/s1