4-[[(3S)-3-(hydroxymethyl)piperidin-1-ium-1-yl]methyl]-2-methoxy-phenol

Systemtic Name: 4-[[(3S)-3-(hydroxymethyl)piperidin-1-ium-1-yl]methyl]-2-methoxy-phenol Openeye Name: 4-[[(3S)-3-(hydroxymethyl)piperidin-1-ium-1-yl]methyl]-2-methoxy-phenol CAS Name: 4-[[(3S)-3-(hydroxymethyl)-1-piperidin-1-iumyl]methyl]-2-methoxyphenol IUPAC Name: 4-[[(3S)-3-(hydroxymethyl)piperidin-1-ium-1-yl]methyl]-2-methoxyphenol Traditional Name: 2-methoxy-4-[[(3S)-3-methylolpiperidin-1-ium-1-yl]methyl]phenol Formula: C14H22NO3+ MolecularWeight: 252.32938

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C[NH+]2CCCC(C2)CO)O

Isomeric SMILES

COC1=C(C=CC(=C1)C[NH+]2CCC[C@@H](C2)CO)O

InChI

InChI=1S/C14H21NO3/c1-18-14-7-11(4-5-13(14)17)8-15-6-2-3-12(9-15)10-16/h4-5,7,12,16-17H,2-3,6,8-10H2,1H3/p+1/t12-/m0/s1