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

Systemtic Name: 2-methyl-3-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]aniline Openeye Name: 2-methyl-3-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]aniline CAS Name: 2-methyl-3-[[(2S)-2-methyl-1-piperidin-1-iumyl]methyl]aniline IUPAC Name: 2-methyl-3-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]aniline Traditional Name: [2-methyl-3-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]phenyl]amine Formula: C14H23N2+ MolecularWeight: 219.34582

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CC2=C(C(=CC=C2)N)C

Isomeric SMILES

C[C@H]1CCCC[NH+]1CC2=C(C(=CC=C2)N)C

InChI

InChI=1S/C14H22N2/c1-11-6-3-4-9-16(11)10-13-7-5-8-14(15)12(13)2/h5,7-8,11H,3-4,6,9-10,15H2,1-2H3/p+1/t11-/m0/s1