[(2S)-butan-2-yl]-[2-[2-(2-methoxy-4-methyl-phenoxy)ethoxy]ethyl]azanium

Systemtic Name: [(2S)-butan-2-yl]-[2-[2-(2-methoxy-4-methyl-phenoxy)ethoxy]ethyl]azanium Openeye Name: 2-[2-(2-methoxy-4-methyl-phenoxy)ethoxy]ethyl-[(1S)-1-methylpropyl]ammonium CAS Name: [(2S)-butan-2-yl]-[2-[2-(2-methoxy-4-methylphenoxy)ethoxy]ethyl]ammonium IUPAC Name: [(2S)-butan-2-yl]-[2-[2-(2-methoxy-4-methylphenoxy)ethoxy]ethyl]azanium Traditional Name: 2-[2-(2-methoxy-4-methyl-phenoxy)ethoxy]ethyl-[(1S)-1-methylpropyl]ammonium Formula: C16H28NO3+ MolecularWeight: 282.39842

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)[NH2+]CCOCCOC1=C(C=C(C=C1)C)OC

Isomeric SMILES

CC[C@H](C)[NH2+]CCOCCOC1=C(C=C(C=C1)C)OC

InChI

InChI=1S/C16H27NO3/c1-5-14(3)17-8-9-19-10-11-20-15-7-6-13(2)12-16(15)18-4/h6-7,12,14,17H,5,8-11H2,1-4H3/p+1/t14-/m0/s1