2-methyl-4-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propoxy]aniline

Systemtic Name: 2-methyl-4-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propoxy]aniline Openeye Name: 2-methyl-4-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propoxy]aniline CAS Name: 2-methyl-4-[3-[(2S)-2-methyl-1-piperidin-1-iumyl]propoxy]aniline IUPAC Name: 2-methyl-4-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propoxy]aniline Traditional Name: [2-methyl-4-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propoxy]phenyl]amine Formula: C16H27N2O+ MolecularWeight: 263.39838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCCOC2=CC(=C(C=C2)N)C

Isomeric SMILES

C[C@H]1CCCC[NH+]1CCCOC2=CC(=C(C=C2)N)C

InChI

InChI=1S/C16H26N2O/c1-13-12-15(7-8-16(13)17)19-11-5-10-18-9-4-3-6-14(18)2/h7-8,12,14H,3-6,9-11,17H2,1-2H3/p+1/t14-/m0/s1