dimethyl 2-[[1-(2,2-dimethylpropanoyl)piperidin-4-yl]carbonylamino]benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-[[1-(2,2-dimethylpropanoyl)piperidin-4-yl]carbonylamino]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[[1-(2,2-dimethylpropanoyl)piperidine-4-carbonyl]amino]benzene-1,4-dicarboxylate CAS Name: 2-[[[1-(2,2-dimethyl-1-oxopropyl)-4-piperidinyl]-oxomethyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[[1-(2,2-dimethylpropanoyl)piperidine-4-carbonyl]amino]benzene-1,4-dicarboxylate Traditional Name: 2-[(1-pivaloylisonipecotoyl)amino]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C21H28N2O6 MolecularWeight: 404.45682

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)N1CCC(CC1)C(=O)NC2=C(C=CC(=C2)C(=O)OC)C(=O)OC

Isomeric SMILES

CC(C)(C)C(=O)N1CCC(CC1)C(=O)NC2=C(C=CC(=C2)C(=O)OC)C(=O)OC

InChI

InChI=1S/C21H28N2O6/c1-21(2,3)20(27)23-10-8-13(9-11-23)17(24)22-16-12-14(18(25)28-4)6-7-15(16)19(26)29-5/h6-7,12-13H,8-11H2,1-5H3,(H,22,24)