4-[(5-cyanopyridin-2-yl)amino]-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylate

Systemtic Name: 4-[(5-cyanopyridin-2-yl)amino]-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylate Openeye Name: 1-tert-butoxycarbonyl-4-[(5-cyano-2-pyridyl)amino]pyrrolidine-2-carboxylate CAS Name: 4-[(5-cyano-2-pyridinyl)amino]-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-2-pyrrolidinecarboxylate IUPAC Name: 4-[(5-cyanopyridin-2-yl)amino]-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylate Traditional Name: 1-tert-butoxycarbonyl-4-[(5-cyano-2-pyridyl)amino]pyrrolidine-2-carboxylate Formula: C16H19N4O4- MolecularWeight: 331.34646

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(CC1C(=O)[O-])NC2=NC=C(C=C2)C#N

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(CC1C(=O)[O-])NC2=NC=C(C=C2)C#N

InChI

InChI=1S/C16H20N4O4/c1-16(2,3)24-15(23)20-9-11(6-12(20)14(21)22)19-13-5-4-10(7-17)8-18-13/h4-5,8,11-12H,6,9H2,1-3H3,(H,18,19)(H,21,22)/p-1