4-[[(2R)-2-(1,2,4-triazol-1-yl)propanoyl]amino]butanoate

Systemtic Name: 4-[[(2R)-2-(1,2,4-triazol-1-yl)propanoyl]amino]butanoate Openeye Name: 4-[[(2R)-2-(1,2,4-triazol-1-yl)propanoyl]amino]butanoate CAS Name: 4-[[(2R)-1-oxo-2-(1,2,4-triazol-1-yl)propyl]amino]butanoate IUPAC Name: 4-[[(2R)-2-(1,2,4-triazol-1-yl)propanoyl]amino]butanoate Traditional Name: 4-[[(2R)-2-(1,2,4-triazol-1-yl)propanoyl]amino]butyrate Formula: C9H13N4O3- MolecularWeight: 225.22452

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCCC(=O)[O-])N1C=NC=N1

Isomeric SMILES

C[C@H](C(=O)NCCCC(=O)[O-])N1C=NC=N1

InChI

InChI=1S/C9H14N4O3/c1-7(13-6-10-5-12-13)9(16)11-4-2-3-8(14)15/h5-7H,2-4H2,1H3,(H,11,16)(H,14,15)/p-1/t7-/m1/s1