2-(4-bromanyl-2-methyl-phenoxy)-1-[4-(phenylmethyl)piperidin-1-yl]ethanone

Systemtic Name: 2-(4-bromanyl-2-methyl-phenoxy)-1-[4-(phenylmethyl)piperidin-1-yl]ethanone Openeye Name: 1-(4-benzyl-1-piperidyl)-2-(4-bromo-2-methyl-phenoxy)ethanone CAS Name: 2-(4-bromo-2-methylphenoxy)-1-[4-(phenylmethyl)-1-piperidinyl]ethanone IUPAC Name: 1-(4-benzylpiperidin-1-yl)-2-(4-bromo-2-methylphenoxy)ethanone Traditional Name: 1-(4-benzylpiperidino)-2-(4-bromo-2-methyl-phenoxy)ethanone Formula: C21H24BrNO2 MolecularWeight: 402.32476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)OCC(=O)N2CCC(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC(=C1)Br)OCC(=O)N2CCC(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C21H24BrNO2/c1-16-13-19(22)7-8-20(16)25-15-21(24)23-11-9-18(10-12-23)14-17-5-3-2-4-6-17/h2-8,13,18H,9-12,14-15H2,1H3