[(2S)-3-(4-ethoxyphenoxy)-2-oxidanyl-propyl]-prop-2-ynyl-azanium

Systemtic Name: [(2S)-3-(4-ethoxyphenoxy)-2-oxidanyl-propyl]-prop-2-ynyl-azanium Openeye Name: [(2S)-3-(4-ethoxyphenoxy)-2-hydroxy-propyl]-prop-2-ynyl-ammonium CAS Name: [(2S)-3-(4-ethoxyphenoxy)-2-hydroxypropyl]-prop-2-ynylammonium IUPAC Name: [(2S)-3-(4-ethoxyphenoxy)-2-hydroxypropyl]-prop-2-ynylazanium Traditional Name: [(2S)-3-(4-ethoxyphenoxy)-2-hydroxy-propyl]-propargyl-ammonium Formula: C14H20NO3+ MolecularWeight: 250.3135

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OCC(C[NH2+]CC#C)O

Isomeric SMILES

CCOC1=CC=C(C=C1)OC[C@H](C[NH2+]CC#C)O

InChI

InChI=1S/C14H19NO3/c1-3-9-15-10-12(16)11-18-14-7-5-13(6-8-14)17-4-2/h1,5-8,12,15-16H,4,9-11H2,2H3/p+1/t12-/m0/s1