1-[2-[2-[(2S)-butan-2-yl]oxyphenoxy]ethyl]-4-methyl-piperazine-1,4-diium

Systemtic Name: 1-[2-[2-[(2S)-butan-2-yl]oxyphenoxy]ethyl]-4-methyl-piperazine-1,4-diium Openeye Name: 1-methyl-4-[2-[2-[(1S)-1-methylpropoxy]phenoxy]ethyl]piperazine-1,4-diium CAS Name: 1-[2-[2-[(2S)-butan-2-yl]oxyphenoxy]ethyl]-4-methylpiperazine-1,4-diium IUPAC Name: 1-[2-[2-[(2S)-butan-2-yl]oxyphenoxy]ethyl]-4-methylpiperazine-1,4-diium Traditional Name: 1-methyl-4-[2-[2-[(1S)-1-methylpropoxy]phenoxy]ethyl]piperazine-1,4-diium Formula: C17H30N2O2+2 MolecularWeight: 294.4323

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=CC=CC=C1OCC[NH+]2CC[NH+](CC2)C

Isomeric SMILES

CC[C@H](C)OC1=CC=CC=C1OCC[NH+]2CC[NH+](CC2)C

InChI

InChI=1S/C17H28N2O2/c1-4-15(2)21-17-8-6-5-7-16(17)20-14-13-19-11-9-18(3)10-12-19/h5-8,15H,4,9-14H2,1-3H3/p+2/t15-/m0/s1