(1S)-1-(4-tert-butylphenyl)-2-piperidin-1-ium-1-yl-ethanamine

Systemtic Name: (1S)-1-(4-tert-butylphenyl)-2-piperidin-1-ium-1-yl-ethanamine Openeye Name: (1S)-1-(4-tert-butylphenyl)-2-piperidin-1-ium-1-yl-ethanamine CAS Name: (1S)-1-(4-tert-butylphenyl)-2-(1-piperidin-1-iumyl)ethanamine IUPAC Name: (1S)-1-(4-tert-butylphenyl)-2-piperidin-1-ium-1-ylethanamine Traditional Name: [(1S)-1-(4-tert-butylphenyl)-2-piperidin-1-ium-1-yl-ethyl]amine Formula: C17H29N2+ MolecularWeight: 261.42556

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(C[NH+]2CCCCC2)N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)[C@@H](C[NH+]2CCCCC2)N

InChI

InChI=1S/C17H28N2/c1-17(2,3)15-9-7-14(8-10-15)16(18)13-19-11-5-4-6-12-19/h7-10,16H,4-6,11-13,18H2,1-3H3/p+1/t16-/m1/s1