(3S)-1-[3-(4-tert-butyl-2-methyl-phenoxy)propyl]-3-methyl-piperidin-1-ium

Systemtic Name: (3S)-1-[3-(4-tert-butyl-2-methyl-phenoxy)propyl]-3-methyl-piperidin-1-ium Openeye Name: (3S)-1-[3-(4-tert-butyl-2-methyl-phenoxy)propyl]-3-methyl-piperidin-1-ium CAS Name: (3S)-1-[3-(4-tert-butyl-2-methylphenoxy)propyl]-3-methylpiperidin-1-ium IUPAC Name: (3S)-1-[3-(4-tert-butyl-2-methylphenoxy)propyl]-3-methylpiperidin-1-ium Traditional Name: (3S)-1-[3-(4-tert-butyl-2-methyl-phenoxy)propyl]-3-methyl-piperidin-1-ium Formula: C20H34NO+ MolecularWeight: 304.49006

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CCCOC2=C(C=C(C=C2)C(C)(C)C)C

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CCCOC2=C(C=C(C=C2)C(C)(C)C)C

InChI

InChI=1S/C20H33NO/c1-16-8-6-11-21(15-16)12-7-13-22-19-10-9-18(14-17(19)2)20(3,4)5/h9-10,14,16H,6-8,11-13,15H2,1-5H3/p+1/t16-/m0/s1