[(2S)-butan-2-yl]-[3-(3-ethylphenoxy)propyl]azanium

Systemtic Name: [(2S)-butan-2-yl]-[3-(3-ethylphenoxy)propyl]azanium Openeye Name: 3-(3-ethylphenoxy)propyl-[(1S)-1-methylpropyl]ammonium CAS Name: [(2S)-butan-2-yl]-[3-(3-ethylphenoxy)propyl]ammonium IUPAC Name: [(2S)-butan-2-yl]-[3-(3-ethylphenoxy)propyl]azanium Traditional Name: 3-(3-ethylphenoxy)propyl-[(1S)-1-methylpropyl]ammonium Formula: C15H26NO+ MolecularWeight: 236.37304

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)OCCC[NH2+]C(C)CC

Isomeric SMILES

CCC1=CC(=CC=C1)OCCC[NH2+][C@@H](C)CC

InChI

InChI=1S/C15H25NO/c1-4-13(3)16-10-7-11-17-15-9-6-8-14(5-2)12-15/h6,8-9,12-13,16H,4-5,7,10-11H2,1-3H3/p+1/t13-/m0/s1