[(2S)-butan-2-yl]-[2-(5-methyl-2-propan-2-yl-phenoxy)ethyl]azanium

Systemtic Name: [(2S)-butan-2-yl]-[2-(5-methyl-2-propan-2-yl-phenoxy)ethyl]azanium Openeye Name: 2-(2-isopropyl-5-methyl-phenoxy)ethyl-[(1S)-1-methylpropyl]ammonium CAS Name: [(2S)-butan-2-yl]-[2-(5-methyl-2-propan-2-ylphenoxy)ethyl]ammonium IUPAC Name: [(2S)-butan-2-yl]-[2-(5-methyl-2-propan-2-ylphenoxy)ethyl]azanium Traditional Name: 2-(2-isopropyl-5-methyl-phenoxy)ethyl-[(1S)-1-methylpropyl]ammonium Formula: C16H28NO+ MolecularWeight: 250.39962

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)[NH2+]CCOC1=C(C=CC(=C1)C)C(C)C

Isomeric SMILES

CC[C@H](C)[NH2+]CCOC1=C(C=CC(=C1)C)C(C)C

InChI

InChI=1S/C16H27NO/c1-6-14(5)17-9-10-18-16-11-13(4)7-8-15(16)12(2)3/h7-8,11-12,14,17H,6,9-10H2,1-5H3/p+1/t14-/m0/s1