tert-butyl 4-[(3-methyl-5-phenylmethoxy-phenoxy)methyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[(3-methyl-5-phenylmethoxy-phenoxy)methyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[(3-benzyloxy-5-methyl-phenoxy)methyl]piperidine-1-carboxylate CAS Name: 4-[(3-methyl-5-phenylmethoxyphenoxy)methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(3-methyl-5-phenylmethoxyphenoxy)methyl]piperidine-1-carboxylate Traditional Name: 4-[(3-benzoxy-5-methyl-phenoxy)methyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C25H33NO4 MolecularWeight: 411.53382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC2CCN(CC2)C(=O)OC(C)(C)C)OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC(=C1)OCC2CCN(CC2)C(=O)OC(C)(C)C)OCC3=CC=CC=C3

InChI

InChI=1S/C25H33NO4/c1-19-14-22(28-17-20-8-6-5-7-9-20)16-23(15-19)29-18-21-10-12-26(13-11-21)24(27)30-25(2,3)4/h5-9,14-16,21H,10-13,17-18H2,1-4H3