[1-[(2S)-2-(4-methoxyphenyl)-2-oxidanyl-ethyl]piperidin-1-ium-4-yl]azanium

Systemtic Name: [1-[(2S)-2-(4-methoxyphenyl)-2-oxidanyl-ethyl]piperidin-1-ium-4-yl]azanium Openeye Name: [1-[(2S)-2-hydroxy-2-(4-methoxyphenyl)ethyl]piperidin-1-ium-4-yl]ammonium CAS Name: [1-[(2S)-2-hydroxy-2-(4-methoxyphenyl)ethyl]-4-piperidin-1-iumyl]ammonium IUPAC Name: [1-[(2S)-2-hydroxy-2-(4-methoxyphenyl)ethyl]piperidin-1-ium-4-yl]azanium Traditional Name: [1-[(2S)-2-hydroxy-2-(4-methoxyphenyl)ethyl]piperidin-1-ium-4-yl]ammonium Formula: C14H24N2O2+2 MolecularWeight: 252.35256

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C[NH+]2CCC(CC2)[NH3+])O

Isomeric SMILES

COC1=CC=C(C=C1)[C@@H](C[NH+]2CCC(CC2)[NH3+])O

InChI

InChI=1S/C14H22N2O2/c1-18-13-4-2-11(3-5-13)14(17)10-16-8-6-12(15)7-9-16/h2-5,12,14,17H,6-10,15H2,1H3/p+2/t14-/m1/s1