N-dodecyl-2,2,6,6-tetramethyl-1-[(2-methylphenyl)methoxy]piperidin-1-ium-1-amine

Systemtic Name: N-dodecyl-2,2,6,6-tetramethyl-1-[(2-methylphenyl)methoxy]piperidin-1-ium-1-amine Openeye Name: N-dodecyl-2,2,6,6-tetramethyl-1-(o-tolylmethoxy)piperidin-1-ium-1-amine CAS Name: N-dodecyl-2,2,6,6-tetramethyl-1-[(2-methylphenyl)methoxy]-1-piperidin-1-iumamine IUPAC Name: N-dodecyl-2,2,6,6-tetramethyl-1-[(2-methylphenyl)methoxy]piperidin-1-ium-1-amine Traditional Name: lauryl-[2,2,6,6-tetramethyl-1-(2-methylbenzyl)oxy-piperidin-1-ium-1-yl]amine Formula: C29H53N2O+ MolecularWeight: 445.74392

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN[N+]1(C(CCCC1(C)C)(C)C)OCC2=CC=CC=C2C

Isomeric SMILES

CCCCCCCCCCCCN[N+]1(C(CCCC1(C)C)(C)C)OCC2=CC=CC=C2C

InChI

InChI=1S/C29H53N2O/c1-7-8-9-10-11-12-13-14-15-18-24-30-31(28(3,4)22-19-23-29(31,5)6)32-25-27-21-17-16-20-26(27)2/h16-17,20-21,30H,7-15,18-19,22-25H2,1-6H3/q+1