3,5-dimethylpyrazol-2-ide; 4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoic acid

Systemtic Name: 3,5-dimethylpyrazol-2-ide; 4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoic acid Openeye Name: 2-(tert-butoxycarbonylamino)-4-methyl-pentanoic acid; 3,5-dimethylpyrazol-2-ide CAS Name: 3,5-dimethylpyrazol-2-ide; 4-methyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]pentanoic acid IUPAC Name: 3,5-dimethylpyrazol-2-ide; 4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoic acid Traditional Name: 2-(tert-butoxycarbonylamino)-4-methyl-valeric acid; 3,5-dimethylpyrazol-2-ide Formula: C16H28N3O4- MolecularWeight: 326.41122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=N[N-]1)C.CC(C)CC(C(=O)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC(=N[N-]1)C.CC(C)CC(C(=O)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C11H21NO4.C5H7N2/c1-7(2)6-8(9(13)14)12-10(15)16-11(3,4)5;1-4-3-5(2)7-6-4/h7-8H,6H2,1-5H3,(H,12,15)(H,13,14);3H,1-2H3/q;-1