[(2S)-butan-2-yl]-[2-[2-(3-propan-2-ylphenoxy)ethoxy]ethyl]azanium

Systemtic Name: [(2S)-butan-2-yl]-[2-[2-(3-propan-2-ylphenoxy)ethoxy]ethyl]azanium Openeye Name: 2-[2-(3-isopropylphenoxy)ethoxy]ethyl-[(1S)-1-methylpropyl]ammonium CAS Name: [(2S)-butan-2-yl]-[2-[2-(3-propan-2-ylphenoxy)ethoxy]ethyl]ammonium IUPAC Name: [(2S)-butan-2-yl]-[2-[2-(3-propan-2-ylphenoxy)ethoxy]ethyl]azanium Traditional Name: 2-[2-(3-isopropylphenoxy)ethoxy]ethyl-[(1S)-1-methylpropyl]ammonium Formula: C17H30NO2+ MolecularWeight: 280.4256

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H29NO2/c1-5-15(4)18-9-10-19-11-12-20-17-8-6-7-16(13-17)14(2)3/h6-8,13-15,18H,5,9-12H2,1-4H3/p+1/t15-/m0/s1