(phenylmethyl) 2-[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]-4-(2-methylpyridin-4-yl)piperazine-1-carboxylate

Systemtic Name: (phenylmethyl) 2-[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]-4-(2-methylpyridin-4-yl)piperazine-1-carboxylate Openeye Name: benzyl 2-(2-tert-butoxy-2-oxo-ethyl)-4-(2-methyl-4-pyridyl)piperazine-1-carboxylate CAS Name: 2-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-4-(2-methyl-4-pyridinyl)-1-piperazinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-4-(2-methylpyridin-4-yl)piperazine-1-carboxylate Traditional Name: 2-(2-tert-butoxy-2-keto-ethyl)-4-(2-methyl-4-pyridyl)piperazine-1-carboxylic acid benzyl ester Formula: C24H31N3O4 MolecularWeight: 425.52064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC(=C1)N2CCN(C(C2)CC(=O)OC(C)(C)C)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=NC=CC(=C1)N2CCN(C(C2)CC(=O)OC(C)(C)C)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C24H31N3O4/c1-18-14-20(10-11-25-18)26-12-13-27(21(16-26)15-22(28)31-24(2,3)4)23(29)30-17-19-8-6-5-7-9-19/h5-11,14,21H,12-13,15-17H2,1-4H3