[(1S)-2-(3-methylbutoxy)-1-(4-propylphenyl)ethyl]azanium

Systemtic Name: [(1S)-2-(3-methylbutoxy)-1-(4-propylphenyl)ethyl]azanium Openeye Name: [(1S)-2-isopentyloxy-1-(4-propylphenyl)ethyl]ammonium CAS Name: [(1S)-2-(3-methylbutoxy)-1-(4-propylphenyl)ethyl]ammonium IUPAC Name: [(1S)-2-(3-methylbutoxy)-1-(4-propylphenyl)ethyl]azanium Traditional Name: [(1S)-2-isoamoxy-1-(4-propylphenyl)ethyl]ammonium Formula: C16H28NO+ MolecularWeight: 250.39962

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(COCCC(C)C)[NH3+]

Isomeric SMILES

CCCC1=CC=C(C=C1)[C@@H](COCCC(C)C)[NH3+]

InChI

InChI=1S/C16H27NO/c1-4-5-14-6-8-15(9-7-14)16(17)12-18-11-10-13(2)3/h6-9,13,16H,4-5,10-12,17H2,1-3H3/p+1/t16-/m1/s1