[(3S)-1-[(5-bromanyl-2-methoxy-phenyl)methyl]piperidin-1-ium-3-yl]methanol

Systemtic Name: [(3S)-1-[(5-bromanyl-2-methoxy-phenyl)methyl]piperidin-1-ium-3-yl]methanol Openeye Name: [(3S)-1-[(5-bromo-2-methoxy-phenyl)methyl]piperidin-1-ium-3-yl]methanol CAS Name: [(3S)-1-[(5-bromo-2-methoxyphenyl)methyl]-3-piperidin-1-iumyl]methanol IUPAC Name: [(3S)-1-[(5-bromo-2-methoxyphenyl)methyl]piperidin-1-ium-3-yl]methanol Traditional Name: [(3S)-1-(5-bromo-2-methoxy-benzyl)piperidin-1-ium-3-yl]methanol Formula: C14H21BrNO2+ MolecularWeight: 315.22604

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20BrNO2/c1-18-14-5-4-13(15)7-12(14)9-16-6-2-3-11(8-16)10-17/h4-5,7,11,17H,2-3,6,8-10H2,1H3/p+1/t11-/m0/s1