(3S)-1-ethyl-N-(4-propan-2-ylphenyl)piperidin-1-ium-3-amine

Systemtic Name: (3S)-1-ethyl-N-(4-propan-2-ylphenyl)piperidin-1-ium-3-amine Openeye Name: (3S)-1-ethyl-N-(4-isopropylphenyl)piperidin-1-ium-3-amine CAS Name: (3S)-1-ethyl-N-(4-propan-2-ylphenyl)-3-piperidin-1-iumamine IUPAC Name: (3S)-1-ethyl-N-(4-propan-2-ylphenyl)piperidin-1-ium-3-amine Traditional Name: [(3S)-1-ethylpiperidin-1-ium-3-yl]-p-cumenyl-amine Formula: C16H27N2+ MolecularWeight: 247.39898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC(C1)NC2=CC=C(C=C2)C(C)C

Isomeric SMILES

CC[NH+]1CCC[C@@H](C1)NC2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C16H26N2/c1-4-18-11-5-6-16(12-18)17-15-9-7-14(8-10-15)13(2)3/h7-10,13,16-17H,4-6,11-12H2,1-3H3/p+1/t16-/m0/s1