3-(3-bromanyl-4-methoxy-phenyl)-1-[3-(hydroxymethyl)piperidin-1-yl]propan-1-one

Systemtic Name: 3-(3-bromanyl-4-methoxy-phenyl)-1-[3-(hydroxymethyl)piperidin-1-yl]propan-1-one Openeye Name: 3-(3-bromo-4-methoxy-phenyl)-1-[3-(hydroxymethyl)-1-piperidyl]propan-1-one CAS Name: 3-(3-bromo-4-methoxyphenyl)-1-[3-(hydroxymethyl)-1-piperidinyl]-1-propanone IUPAC Name: 3-(3-bromo-4-methoxyphenyl)-1-[3-(hydroxymethyl)piperidin-1-yl]propan-1-one Traditional Name: 3-(3-bromo-4-methoxy-phenyl)-1-(3-methylolpiperidino)propan-1-one Formula: C16H22BrNO3 MolecularWeight: 356.25478

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCC(=O)N2CCCC(C2)CO)Br

Isomeric SMILES

COC1=C(C=C(C=C1)CCC(=O)N2CCCC(C2)CO)Br

InChI

InChI=1S/C16H22BrNO3/c1-21-15-6-4-12(9-14(15)17)5-7-16(20)18-8-2-3-13(10-18)11-19/h4,6,9,13,19H,2-3,5,7-8,10-11H2,1H3