N-ethyl-2-methyl-N-[[(3S)-piperidin-1-ium-3-yl]methyl]aniline

Systemtic Name: N-ethyl-2-methyl-N-[[(3S)-piperidin-1-ium-3-yl]methyl]aniline Openeye Name: N-ethyl-2-methyl-N-[[(3S)-piperidin-1-ium-3-yl]methyl]aniline CAS Name: N-ethyl-2-methyl-N-[[(3S)-3-piperidin-1-iumyl]methyl]aniline IUPAC Name: N-ethyl-2-methyl-N-[[(3S)-piperidin-1-ium-3-yl]methyl]aniline Traditional Name: ethyl-(o-tolyl)-[[(3S)-piperidin-1-ium-3-yl]methyl]amine Formula: C15H25N2+ MolecularWeight: 233.3724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1CCC[NH2+]C1)C2=CC=CC=C2C

Isomeric SMILES

CCN(C[C@H]1CCC[NH2+]C1)C2=CC=CC=C2C

InChI

InChI=1S/C15H24N2/c1-3-17(12-14-8-6-10-16-11-14)15-9-5-4-7-13(15)2/h4-5,7,9,14,16H,3,6,8,10-12H2,1-2H3/p+1/t14-/m0/s1