1-[(2S)-2-ethylhexyl]-4-methyl-piperidin-1-ium

Systemtic Name: 1-[(2S)-2-ethylhexyl]-4-methyl-piperidin-1-ium Openeye Name: 1-[(2S)-2-ethylhexyl]-4-methyl-piperidin-1-ium CAS Name: 1-[(2S)-2-ethylhexyl]-4-methylpiperidin-1-ium IUPAC Name: 1-[(2S)-2-ethylhexyl]-4-methylpiperidin-1-ium Traditional Name: 1-[(2S)-2-ethylhexyl]-4-methyl-piperidin-1-ium Formula: C14H30N+ MolecularWeight: 212.3947

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C[NH+]1CCC(CC1)C

Isomeric SMILES

CCCC[C@H](CC)C[NH+]1CCC(CC1)C

InChI

InChI=1S/C14H29N/c1-4-6-7-14(5-2)12-15-10-8-13(3)9-11-15/h13-14H,4-12H2,1-3H3/p+1/t14-/m0/s1