1-[4-[2-[(2S)-butan-2-yl]phenoxy]butyl]-4-methyl-piperidin-1-ium

Systemtic Name: 1-[4-[2-[(2S)-butan-2-yl]phenoxy]butyl]-4-methyl-piperidin-1-ium Openeye Name: 4-methyl-1-[4-[2-[(1S)-1-methylpropyl]phenoxy]butyl]piperidin-1-ium CAS Name: 1-[4-[2-[(2S)-butan-2-yl]phenoxy]butyl]-4-methylpiperidin-1-ium IUPAC Name: 1-[4-[2-[(2S)-butan-2-yl]phenoxy]butyl]-4-methylpiperidin-1-ium Traditional Name: 4-methyl-1-[4-[2-[(1S)-1-methylpropyl]phenoxy]butyl]piperidin-1-ium Formula: C20H34NO+ MolecularWeight: 304.49006

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1OCCCC[NH+]2CCC(CC2)C

Isomeric SMILES

CC[C@H](C)C1=CC=CC=C1OCCCC[NH+]2CCC(CC2)C

InChI

InChI=1S/C20H33NO/c1-4-18(3)19-9-5-6-10-20(19)22-16-8-7-13-21-14-11-17(2)12-15-21/h5-6,9-10,17-18H,4,7-8,11-16H2,1-3H3/p+1/t18-/m0/s1