tert-butyl 1-[[3-[3-(2-acetyloxyethanoylamino)propoxy]phenyl]methyl]piperidine-4-carboxylate

Systemtic Name: tert-butyl 1-[[3-[3-(2-acetyloxyethanoylamino)propoxy]phenyl]methyl]piperidine-4-carboxylate Openeye Name: tert-butyl 1-[[3-[3-[(2-acetoxyacetyl)amino]propoxy]phenyl]methyl]piperidine-4-carboxylate CAS Name: 1-[[3-[3-[(2-acetyloxy-1-oxoethyl)amino]propoxy]phenyl]methyl]-4-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-[[3-[3-[(2-acetyloxyacetyl)amino]propoxy]phenyl]methyl]piperidine-4-carboxylate Traditional Name: 1-[3-[3-[(2-acetoxyacetyl)amino]propoxy]benzyl]isonipecotic acid tert-butyl ester Formula: C24H36N2O6 MolecularWeight: 448.55244

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(=O)NCCCOC1=CC=CC(=C1)CN2CCC(CC2)C(=O)OC(C)(C)C

Isomeric SMILES

CC(=O)OCC(=O)NCCCOC1=CC=CC(=C1)CN2CCC(CC2)C(=O)OC(C)(C)C

InChI

InChI=1S/C24H36N2O6/c1-18(27)31-17-22(28)25-11-6-14-30-21-8-5-7-19(15-21)16-26-12-9-20(10-13-26)23(29)32-24(2,3)4/h5,7-8,15,20H,6,9-14,16-17H2,1-4H3,(H,25,28)