methyl 2-[1-(phenylmethyl)piperidin-1-ium-1-yl]ethanoate bromide

Systemtic Name: methyl 2-[1-(phenylmethyl)piperidin-1-ium-1-yl]ethanoate bromide Openeye Name: methyl 2-(1-benzylpiperidin-1-ium-1-yl)acetate bromide CAS Name: 2-[1-(phenylmethyl)-1-piperidin-1-iumyl]acetic acid methyl ester bromide IUPAC Name: methyl 2-(1-benzylpiperidin-1-ium-1-yl)acetate bromide Traditional Name: 2-(1-benzylpiperidin-1-ium-1-yl)acetic acid methyl ester bromide Formula: C15H22BrNO2 MolecularWeight: 328.24468

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C[N+]1(CCCCC1)CC2=CC=CC=C2.[Br-]

Isomeric SMILES

COC(=O)C[N+]1(CCCCC1)CC2=CC=CC=C2.[Br-]

InChI

InChI=1S/C15H22NO2.BrH/c1-18-15(17)13-16(10-6-3-7-11-16)12-14-8-4-2-5-9-14;/h2,4-5,8-9H,3,6-7,10-13H2,1H3;1H/q+1;/p-1