methyl 2-[1-[(3-hydroxyphenyl)methyl]piperidin-1-ium-4-yl]ethanoate

Systemtic Name: methyl 2-[1-[(3-hydroxyphenyl)methyl]piperidin-1-ium-4-yl]ethanoate Openeye Name: methyl 2-[1-[(3-hydroxyphenyl)methyl]piperidin-1-ium-4-yl]acetate CAS Name: 2-[1-[(3-hydroxyphenyl)methyl]-4-piperidin-1-iumyl]acetic acid methyl ester IUPAC Name: methyl 2-[1-[(3-hydroxyphenyl)methyl]piperidin-1-ium-4-yl]acetate Traditional Name: 2-[1-(3-hydroxybenzyl)piperidin-1-ium-4-yl]acetic acid methyl ester Formula: C15H22NO3+ MolecularWeight: 264.34008

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1CC[NH+](CC1)CC2=CC(=CC=C2)O

Isomeric SMILES

COC(=O)CC1CC[NH+](CC1)CC2=CC(=CC=C2)O

InChI

InChI=1S/C15H21NO3/c1-19-15(18)10-12-5-7-16(8-6-12)11-13-3-2-4-14(17)9-13/h2-4,9,12,17H,5-8,10-11H2,1H3/p+1