[(2R)-2-(4-tert-butylphenyl)-2-[4-(hydroxymethyl)piperidin-1-ium-1-yl]ethyl]azanium

Systemtic Name: [(2R)-2-(4-tert-butylphenyl)-2-[4-(hydroxymethyl)piperidin-1-ium-1-yl]ethyl]azanium Openeye Name: [(2R)-2-(4-tert-butylphenyl)-2-[4-(hydroxymethyl)piperidin-1-ium-1-yl]ethyl]ammonium CAS Name: [(2R)-2-(4-tert-butylphenyl)-2-[4-(hydroxymethyl)-1-piperidin-1-iumyl]ethyl]ammonium IUPAC Name: [(2R)-2-(4-tert-butylphenyl)-2-[4-(hydroxymethyl)piperidin-1-ium-1-yl]ethyl]azanium Traditional Name: [(2R)-2-(4-tert-butylphenyl)-2-(4-methylolpiperidin-1-ium-1-yl)ethyl]ammonium Formula: C18H32N2O+2 MolecularWeight: 292.45948

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H30N2O/c1-18(2,3)16-6-4-15(5-7-16)17(12-19)20-10-8-14(13-21)9-11-20/h4-7,14,17,21H,8-13,19H2,1-3H3/p+2/t17-/m0/s1