4-(2-azanylethyl)-5-tert-butyl-1,2-dihydropyrazol-3-one

Systemtic Name: 4-(2-azanylethyl)-5-tert-butyl-1,2-dihydropyrazol-3-one Openeye Name: 4-(2-aminoethyl)-5-tert-butyl-1,2-dihydropyrazol-3-one CAS Name: 4-(2-aminoethyl)-5-tert-butyl-1,2-dihydropyrazol-3-one IUPAC Name: 4-(2-aminoethyl)-5-tert-butyl-1,2-dihydropyrazol-3-one Traditional Name: 4-(2-aminoethyl)-5-tert-butyl-3-pyrazolin-3-one Formula: C9H17N3O MolecularWeight: 183.25078

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C(=O)NN1)CCN

Isomeric SMILES

CC(C)(C)C1=C(C(=O)NN1)CCN

InChI

InChI=1S/C9H17N3O/c1-9(2,3)7-6(4-5-10)8(13)12-11-7/h4-5,10H2,1-3H3,(H2,11,12,13)