(3S)-3-[(4-tert-butylphenyl)methoxymethyl]piperidin-1-ium

Systemtic Name: (3S)-3-[(4-tert-butylphenyl)methoxymethyl]piperidin-1-ium Openeye Name: (3S)-3-[(4-tert-butylphenyl)methoxymethyl]piperidin-1-ium CAS Name: (3S)-3-[(4-tert-butylphenyl)methoxymethyl]piperidin-1-ium IUPAC Name: (3S)-3-[(4-tert-butylphenyl)methoxymethyl]piperidin-1-ium Traditional Name: (3S)-3-[(4-tert-butylbenzyl)oxymethyl]piperidin-1-ium Formula: C17H28NO+ MolecularWeight: 262.41032

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)COCC2CCC[NH2+]C2

Isomeric SMILES

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

InChI

InChI=1S/C17H27NO/c1-17(2,3)16-8-6-14(7-9-16)12-19-13-15-5-4-10-18-11-15/h6-9,15,18H,4-5,10-13H2,1-3H3/p+1/t15-/m0/s1