[(2S)-4-(4-propan-2-ylphenoxy)butan-2-yl]azanium

Systemtic Name: [(2S)-4-(4-propan-2-ylphenoxy)butan-2-yl]azanium Openeye Name: [(1S)-3-(4-isopropylphenoxy)-1-methyl-propyl]ammonium CAS Name: [(2S)-4-(4-propan-2-ylphenoxy)butan-2-yl]ammonium IUPAC Name: [(2S)-4-(4-propan-2-ylphenoxy)butan-2-yl]azanium Traditional Name: [(1S)-3-(4-isopropylphenoxy)-1-methyl-propyl]ammonium Formula: C13H22NO+ MolecularWeight: 208.31988

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)OCCC(C)[NH3+]

Isomeric SMILES

C[C@@H](CCOC1=CC=C(C=C1)C(C)C)[NH3+]

InChI

InChI=1S/C13H21NO/c1-10(2)12-4-6-13(7-5-12)15-9-8-11(3)14/h4-7,10-11H,8-9,14H2,1-3H3/p+1/t11-/m0/s1