tert-butyl 3-[(3-tert-butyl-5-chloranyl-phenyl)methoxy]-2-phenyl-piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-[(3-tert-butyl-5-chloranyl-phenyl)methoxy]-2-phenyl-piperidine-1-carboxylate Openeye Name: tert-butyl 3-[(3-tert-butyl-5-chloro-phenyl)methoxy]-2-phenyl-piperidine-1-carboxylate CAS Name: 3-[(3-tert-butyl-5-chlorophenyl)methoxy]-2-phenyl-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[(3-tert-butyl-5-chlorophenyl)methoxy]-2-phenylpiperidine-1-carboxylate Traditional Name: 3-(3-tert-butyl-5-chloro-benzyl)oxy-2-phenyl-piperidine-1-carboxylic acid tert-butyl ester Formula: C27H36ClNO3 MolecularWeight: 458.03264

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1)COC2CCCN(C2C3=CC=CC=C3)C(=O)OC(C)(C)C)Cl

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1)COC2CCCN(C2C3=CC=CC=C3)C(=O)OC(C)(C)C)Cl

InChI

InChI=1S/C27H36ClNO3/c1-26(2,3)21-15-19(16-22(28)17-21)18-31-23-13-10-14-29(25(30)32-27(4,5)6)24(23)20-11-8-7-9-12-20/h7-9,11-12,15-17,23-24H,10,13-14,18H2,1-6H3