ethyl 1-[1-(2-acetamidoethanoyl)piperidin-4-yl]-5-tert-butyl-pyrazole-3-carboxylate

Systemtic Name: ethyl 1-[1-(2-acetamidoethanoyl)piperidin-4-yl]-5-tert-butyl-pyrazole-3-carboxylate Openeye Name: ethyl 1-[1-(2-acetamidoacetyl)-4-piperidyl]-5-tert-butyl-pyrazole-3-carboxylate CAS Name: 1-[1-(2-acetamido-1-oxoethyl)-4-piperidinyl]-5-tert-butyl-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1-(2-acetamidoacetyl)piperidin-4-yl]-5-tert-butylpyrazole-3-carboxylate Traditional Name: 1-[1-(2-acetamidoacetyl)-4-piperidyl]-5-tert-butyl-pyrazole-3-carboxylic acid ethyl ester Formula: C19H30N4O4 MolecularWeight: 378.4659

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=C1)C(C)(C)C)C2CCN(CC2)C(=O)CNC(=O)C

Isomeric SMILES

CCOC(=O)C1=NN(C(=C1)C(C)(C)C)C2CCN(CC2)C(=O)CNC(=O)C

InChI

InChI=1S/C19H30N4O4/c1-6-27-18(26)15-11-16(19(3,4)5)23(21-15)14-7-9-22(10-8-14)17(25)12-20-13(2)24/h11,14H,6-10,12H2,1-5H3,(H,20,24)