(3S)-3-[(4-propan-2-ylphenoxy)methyl]piperidin-1-ium

Systemtic Name: (3S)-3-[(4-propan-2-ylphenoxy)methyl]piperidin-1-ium Openeye Name: (3S)-3-[(4-isopropylphenoxy)methyl]piperidin-1-ium CAS Name: (3S)-3-[(4-propan-2-ylphenoxy)methyl]piperidin-1-ium IUPAC Name: (3S)-3-[(4-propan-2-ylphenoxy)methyl]piperidin-1-ium Traditional Name: (3S)-3-[(4-isopropylphenoxy)methyl]piperidin-1-ium Formula: C15H24NO+ MolecularWeight: 234.35716

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)OCC2CCC[NH2+]C2

Isomeric SMILES

CC(C)C1=CC=C(C=C1)OC[C@H]2CCC[NH2+]C2

InChI

InChI=1S/C15H23NO/c1-12(2)14-5-7-15(8-6-14)17-11-13-4-3-9-16-10-13/h5-8,12-13,16H,3-4,9-11H2,1-2H3/p+1/t13-/m0/s1