[1-[2-(2-tert-butyl-6-methyl-phenoxy)ethyl]piperidin-4-yl]azanium

Systemtic Name: [1-[2-(2-tert-butyl-6-methyl-phenoxy)ethyl]piperidin-4-yl]azanium Openeye Name: [1-[2-(2-tert-butyl-6-methyl-phenoxy)ethyl]-4-piperidyl]ammonium CAS Name: [1-[2-(2-tert-butyl-6-methylphenoxy)ethyl]-4-piperidinyl]ammonium IUPAC Name: [1-[2-(2-tert-butyl-6-methylphenoxy)ethyl]piperidin-4-yl]azanium Traditional Name: [1-[2-(2-tert-butyl-6-methyl-phenoxy)ethyl]-4-piperidyl]ammonium Formula: C18H31N2O+ MolecularWeight: 291.45154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C(C)(C)C)OCCN2CCC(CC2)[NH3+]

Isomeric SMILES

CC1=C(C(=CC=C1)C(C)(C)C)OCCN2CCC(CC2)[NH3+]

InChI

InChI=1S/C18H30N2O/c1-14-6-5-7-16(18(2,3)4)17(14)21-13-12-20-10-8-15(19)9-11-20/h5-7,15H,8-13,19H2,1-4H3/p+1