3-(3,4-diethyl-5-oxidanylidene-1,2,4-triazol-1-yl)propanoic acid

Systemtic Name: 3-(3,4-diethyl-5-oxidanylidene-1,2,4-triazol-1-yl)propanoic acid Openeye Name: 3-(3,4-diethyl-5-oxo-1,2,4-triazol-1-yl)propanoic acid CAS Name: 3-(3,4-diethyl-5-oxo-1,2,4-triazol-1-yl)propanoic acid IUPAC Name: 3-(3,4-diethyl-5-oxo-1,2,4-triazol-1-yl)propanoic acid Traditional Name: 3-(3,4-diethyl-5-keto-1,2,4-triazol-1-yl)propionic acid Formula: C9H15N3O3 MolecularWeight: 213.2337

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=O)N1CC)CCC(=O)O

Isomeric SMILES

CCC1=NN(C(=O)N1CC)CCC(=O)O

InChI

InChI=1S/C9H15N3O3/c1-3-7-10-12(6-5-8(13)14)9(15)11(7)4-2/h3-6H2,1-2H3,(H,13,14)