1-[2-[3-[(2S)-butan-2-yl]oxyphenoxy]ethyl]-4-methyl-piperazin-4-ium

Systemtic Name: 1-[2-[3-[(2S)-butan-2-yl]oxyphenoxy]ethyl]-4-methyl-piperazin-4-ium Openeye Name: 1-methyl-4-[2-[3-[(1S)-1-methylpropoxy]phenoxy]ethyl]piperazin-1-ium CAS Name: 1-[2-[3-[(2S)-butan-2-yl]oxyphenoxy]ethyl]-4-methylpiperazin-4-ium IUPAC Name: 1-[2-[3-[(2S)-butan-2-yl]oxyphenoxy]ethyl]-4-methylpiperazin-4-ium Traditional Name: 1-methyl-4-[2-[3-[(1S)-1-methylpropoxy]phenoxy]ethyl]piperazin-1-ium Formula: C17H29N2O2+ MolecularWeight: 293.42436

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=CC=CC(=C1)OCCN2CC[NH+](CC2)C

Isomeric SMILES

CC[C@H](C)OC1=CC=CC(=C1)OCCN2CC[NH+](CC2)C

InChI

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