tert-butyl 3-[(4-bromophenyl)methoxy]-4-(4-hydroxyphenyl)piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-[(4-bromophenyl)methoxy]-4-(4-hydroxyphenyl)piperidine-1-carboxylate Openeye Name: tert-butyl 3-[(4-bromophenyl)methoxy]-4-(4-hydroxyphenyl)piperidine-1-carboxylate CAS Name: 3-[(4-bromophenyl)methoxy]-4-(4-hydroxyphenyl)-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[(4-bromophenyl)methoxy]-4-(4-hydroxyphenyl)piperidine-1-carboxylate Traditional Name: 3-(4-bromobenzyl)oxy-4-(4-hydroxyphenyl)piperidine-1-carboxylic acid tert-butyl ester Formula: C23H28BrNO4 MolecularWeight: 462.37672

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(C(C1)OCC2=CC=C(C=C2)Br)C3=CC=C(C=C3)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(C(C1)OCC2=CC=C(C=C2)Br)C3=CC=C(C=C3)O

InChI

InChI=1S/C23H28BrNO4/c1-23(2,3)29-22(27)25-13-12-20(17-6-10-19(26)11-7-17)21(14-25)28-15-16-4-8-18(24)9-5-16/h4-11,20-21,26H,12-15H2,1-3H3