1-[(1S)-1-(2,4,6-trimethylphenyl)ethyl]piperidin-1-ium-4-amine

Systemtic Name: 1-[(1S)-1-(2,4,6-trimethylphenyl)ethyl]piperidin-1-ium-4-amine Openeye Name: 1-[(1S)-1-(2,4,6-trimethylphenyl)ethyl]piperidin-1-ium-4-amine CAS Name: 1-[(1S)-1-(2,4,6-trimethylphenyl)ethyl]-4-piperidin-1-iumamine IUPAC Name: 1-[(1S)-1-(2,4,6-trimethylphenyl)ethyl]piperidin-1-ium-4-amine Traditional Name: [1-[(1S)-1-mesitylethyl]piperidin-1-ium-4-yl]amine Formula: C16H27N2+ MolecularWeight: 247.39898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C(C)[NH+]2CCC(CC2)N)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)[C@H](C)[NH+]2CCC(CC2)N)C

InChI

InChI=1S/C16H26N2/c1-11-9-12(2)16(13(3)10-11)14(4)18-7-5-15(17)6-8-18/h9-10,14-15H,5-8,17H2,1-4H3/p+1/t14-/m0/s1