[(3S,4S)-3-[4-(2-methylbutan-2-yl)phenoxy]heptan-4-yl]azanium

Systemtic Name: [(3S,4S)-3-[4-(2-methylbutan-2-yl)phenoxy]heptan-4-yl]azanium Openeye Name: [(1S,2S)-2-[4-(1,1-dimethylpropyl)phenoxy]-1-propyl-butyl]ammonium CAS Name: [(3S,4S)-3-[4-(2-methylbutan-2-yl)phenoxy]heptan-4-yl]ammonium IUPAC Name: [(3S,4S)-3-[4-(2-methylbutan-2-yl)phenoxy]heptan-4-yl]azanium Traditional Name: [(1S,2S)-2-(4-tert-amylphenoxy)-1-propyl-butyl]ammonium Formula: C18H32NO+ MolecularWeight: 278.45278

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(CC)OC1=CC=C(C=C1)C(C)(C)CC)[NH3+]

Isomeric SMILES

CCC[C@@H]([C@H](CC)OC1=CC=C(C=C1)C(C)(C)CC)[NH3+]

InChI

InChI=1S/C18H31NO/c1-6-9-16(19)17(7-2)20-15-12-10-14(11-13-15)18(4,5)8-3/h10-13,16-17H,6-9,19H2,1-5H3/p+1/t16-,17-/m0/s1