4-ethyl-4-methyl-1-oxidanyl-1-(phenylmethyl)piperidin-1-ium; 2-(2-methylbutoxy)aniline

Systemtic Name: 4-ethyl-4-methyl-1-oxidanyl-1-(phenylmethyl)piperidin-1-ium; 2-(2-methylbutoxy)aniline Openeye Name: 1-benzyl-4-ethyl-1-hydroxy-4-methyl-piperidin-1-ium; 2-(2-methylbutoxy)aniline CAS Name: 4-ethyl-1-hydroxy-4-methyl-1-(phenylmethyl)piperidin-1-ium; 2-(2-methylbutoxy)aniline IUPAC Name: 1-benzyl-4-ethyl-1-hydroxy-4-methylpiperidin-1-ium; 2-(2-methylbutoxy)aniline Traditional Name: 1-benzyl-4-ethyl-1-hydroxy-4-methyl-piperidin-1-ium; [2-(2-methylbutoxy)phenyl]amine Formula: C26H41N2O2+ MolecularWeight: 413.61594

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)COC1=CC=CC=C1N.CCC1(CC[N+](CC1)(CC2=CC=CC=C2)O)C

Isomeric SMILES

CCC(C)COC1=CC=CC=C1N.CCC1(CC[N+](CC1)(CC2=CC=CC=C2)O)C

InChI

InChI=1S/C15H24NO.C11H17NO/c1-3-15(2)9-11-16(17,12-10-15)13-14-7-5-4-6-8-14;1-3-9(2)8-13-11-7-5-4-6-10(11)12/h4-8,17H,3,9-13H2,1-2H3;4-7,9H,3,8,12H2,1-2H3/q+1;