[1-[(4R)-4-(4-methoxyphenyl)-4-oxidanyl-butyl]piperidin-1-ium-4-yl]azanium

Systemtic Name: [1-[(4R)-4-(4-methoxyphenyl)-4-oxidanyl-butyl]piperidin-1-ium-4-yl]azanium Openeye Name: [1-[(4R)-4-hydroxy-4-(4-methoxyphenyl)butyl]piperidin-1-ium-4-yl]ammonium CAS Name: [1-[(4R)-4-hydroxy-4-(4-methoxyphenyl)butyl]-4-piperidin-1-iumyl]ammonium IUPAC Name: [1-[(4R)-4-hydroxy-4-(4-methoxyphenyl)butyl]piperidin-1-ium-4-yl]azanium Traditional Name: [1-[(4R)-4-hydroxy-4-(4-methoxyphenyl)butyl]piperidin-1-ium-4-yl]ammonium Formula: C16H28N2O2+2 MolecularWeight: 280.40572

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H26N2O2/c1-20-15-6-4-13(5-7-15)16(19)3-2-10-18-11-8-14(17)9-12-18/h4-7,14,16,19H,2-3,8-12,17H2,1H3/p+2/t16-/m1/s1