1-ethyl-4-methyl-1-(phenylmethyl)piperidin-1-ium-2-ol; 4-propoxyaniline

Systemtic Name: 1-ethyl-4-methyl-1-(phenylmethyl)piperidin-1-ium-2-ol; 4-propoxyaniline Openeye Name: 1-benzyl-1-ethyl-4-methyl-piperidin-1-ium-2-ol; 4-propoxyaniline CAS Name: 1-ethyl-4-methyl-1-(phenylmethyl)-2-piperidin-1-iumol; 4-propoxyaniline IUPAC Name: 1-benzyl-1-ethyl-4-methylpiperidin-1-ium-2-ol; 4-propoxyaniline Traditional Name: 1-benzyl-1-ethyl-4-methyl-piperidin-1-ium-2-ol; (4-propoxyphenyl)amine Formula: C24H37N2O2+ MolecularWeight: 385.56278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)N.CC[N+]1(CCC(CC1O)C)CC2=CC=CC=C2

Isomeric SMILES

CCCOC1=CC=C(C=C1)N.CC[N+]1(CCC(CC1O)C)CC2=CC=CC=C2

InChI

InChI=1S/C15H24NO.C9H13NO/c1-3-16(10-9-13(2)11-15(16)17)12-14-7-5-4-6-8-14;1-2-7-11-9-5-3-8(10)4-6-9/h4-8,13,15,17H,3,9-12H2,1-2H3;3-6H,2,7,10H2,1H3/q+1;