1-(diphenylmethyl)-4-(4-ethoxyphenyl)-1-ethyl-piperidin-1-ium-2-ol; methanamine

Systemtic Name: 1-(diphenylmethyl)-4-(4-ethoxyphenyl)-1-ethyl-piperidin-1-ium-2-ol; methanamine Openeye Name: 1-benzhydryl-4-(4-ethoxyphenyl)-1-ethyl-piperidin-1-ium-2-ol; methanamine CAS Name: 1-(diphenylmethyl)-4-(4-ethoxyphenyl)-1-ethyl-2-piperidin-1-iumol; methanamine IUPAC Name: 1-benzhydryl-4-(4-ethoxyphenyl)-1-ethylpiperidin-1-ium-2-ol; methanamine Traditional Name: 1-benzhydryl-1-ethyl-4-p-phenetyl-piperidin-1-ium-2-ol; methylamine Formula: C29H39N2O2+ MolecularWeight: 447.63216

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(CCC(CC1O)C2=CC=C(C=C2)OCC)C(C3=CC=CC=C3)C4=CC=CC=C4.CN

Isomeric SMILES

CC[N+]1(CCC(CC1O)C2=CC=C(C=C2)OCC)C(C3=CC=CC=C3)C4=CC=CC=C4.CN

InChI

InChI=1S/C28H34NO2.CH5N/c1-3-29(28(23-11-7-5-8-12-23)24-13-9-6-10-14-24)20-19-25(21-27(29)30)22-15-17-26(18-16-22)31-4-2;1-2/h5-18,25,27-28,30H,3-4,19-21H2,1-2H3;2H2,1H3/q+1;