5-azanyl-2-[3-(3,5-dimethylpyrazol-1-yl)propanoylamino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-azanyl-2-[3-(3,5-dimethylpyrazol-1-yl)propanoylamino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-amino-2-[3-(3,5-dimethylpyrazol-1-yl)propanoylamino]-5-oxo-pentanoic acid CAS Name: 5-amino-2-[[3-(3,5-dimethyl-1-pyrazolyl)-1-oxopropyl]amino]-5-oxopentanoic acid IUPAC Name: 5-amino-2-[3-(3,5-dimethylpyrazol-1-yl)propanoylamino]-5-oxopentanoic acid Traditional Name: 5-amino-2-[3-(3,5-dimethylpyrazol-1-yl)propanoylamino]-5-keto-valeric acid Formula: C13H20N4O4 MolecularWeight: 296.3223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCC(=O)NC(CCC(=O)N)C(=O)O)C

Isomeric SMILES

CC1=CC(=NN1CCC(=O)NC(CCC(=O)N)C(=O)O)C

InChI

InChI=1S/C13H20N4O4/c1-8-7-9(2)17(16-8)6-5-12(19)15-10(13(20)21)3-4-11(14)18/h7,10H,3-6H2,1-2H3,(H2,14,18)(H,15,19)(H,20,21)