tert-butyl 4-[4-[2-[(3-benzamido-2-methyl-propanoyl)oxymethyl]phenoxy]butyl]piperidine-4-carboxylate

Systemtic Name: tert-butyl 4-[4-[2-[(3-benzamido-2-methyl-propanoyl)oxymethyl]phenoxy]butyl]piperidine-4-carboxylate Openeye Name: tert-butyl 4-[4-[2-[(3-benzamido-2-methyl-propanoyl)oxymethyl]phenoxy]butyl]piperidine-4-carboxylate CAS Name: 4-[4-[2-[(3-benzamido-2-methyl-1-oxopropoxy)methyl]phenoxy]butyl]-4-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[2-[(3-benzamido-2-methylpropanoyl)oxymethyl]phenoxy]butyl]piperidine-4-carboxylate Traditional Name: 4-[4-[2-[(3-benzamido-2-methyl-propanoyl)oxymethyl]phenoxy]butyl]isonipecotic acid tert-butyl ester Formula: C32H44N2O6 MolecularWeight: 552.70156

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C1=CC=CC=C1)C(=O)OCC2=CC=CC=C2OCCCCC3(CCNCC3)C(=O)OC(C)(C)C

Isomeric SMILES

CC(CNC(=O)C1=CC=CC=C1)C(=O)OCC2=CC=CC=C2OCCCCC3(CCNCC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C32H44N2O6/c1-24(22-34-28(35)25-12-6-5-7-13-25)29(36)39-23-26-14-8-9-15-27(26)38-21-11-10-16-32(17-19-33-20-18-32)30(37)40-31(2,3)4/h5-9,12-15,24,33H,10-11,16-23H2,1-4H3,(H,34,35)