tert-butyl 2-[4-(2-azanylpyridin-4-yl)carbonylpiperazin-1-yl]ethanoate

Systemtic Name: tert-butyl 2-[4-(2-azanylpyridin-4-yl)carbonylpiperazin-1-yl]ethanoate Openeye Name: tert-butyl 2-[4-(2-aminopyridine-4-carbonyl)piperazin-1-yl]acetate CAS Name: 2-[4-[(2-amino-4-pyridinyl)-oxomethyl]-1-piperazinyl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[4-(2-aminopyridine-4-carbonyl)piperazin-1-yl]acetate Traditional Name: 2-[4-(2-aminoisonicotinoyl)piperazino]acetic acid tert-butyl ester Formula: C16H24N4O3 MolecularWeight: 320.38676

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CN1CCN(CC1)C(=O)C2=CC(=NC=C2)N

Isomeric SMILES

CC(C)(C)OC(=O)CN1CCN(CC1)C(=O)C2=CC(=NC=C2)N

InChI

InChI=1S/C16H24N4O3/c1-16(2,3)23-14(21)11-19-6-8-20(9-7-19)15(22)12-4-5-18-13(17)10-12/h4-5,10H,6-9,11H2,1-3H3,(H2,17,18)