2-(4-bromanyl-2,3,5-trimethyl-phenoxy)-1-[4-(phenylmethyl)piperidin-1-yl]ethanone

Systemtic Name: 2-(4-bromanyl-2,3,5-trimethyl-phenoxy)-1-[4-(phenylmethyl)piperidin-1-yl]ethanone Openeye Name: 1-(4-benzyl-1-piperidyl)-2-(4-bromo-2,3,5-trimethyl-phenoxy)ethanone CAS Name: 2-(4-bromo-2,3,5-trimethylphenoxy)-1-[4-(phenylmethyl)-1-piperidinyl]ethanone IUPAC Name: 1-(4-benzylpiperidin-1-yl)-2-(4-bromo-2,3,5-trimethylphenoxy)ethanone Traditional Name: 1-(4-benzylpiperidino)-2-(4-bromo-2,3,5-trimethyl-phenoxy)ethanone Formula: C23H28BrNO2 MolecularWeight: 430.37792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1Br)C)C)OCC(=O)N2CCC(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C(=C1Br)C)C)OCC(=O)N2CCC(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C23H28BrNO2/c1-16-13-21(17(2)18(3)23(16)24)27-15-22(26)25-11-9-20(10-12-25)14-19-7-5-4-6-8-19/h4-8,13,20H,9-12,14-15H2,1-3H3