N-ethyl-N-(4-oxidanylbut-2-ynyl)benzeneamine oxide

Systemtic Name: N-ethyl-N-(4-oxidanylbut-2-ynyl)benzeneamine oxide Openeye Name: N-ethyl-N-(4-hydroxybut-2-ynyl)benzeneamine oxide CAS Name: N-ethyl-N-(4-hydroxybut-2-ynyl)benzeneamine oxide IUPAC Name: N-ethyl-N-(4-hydroxybut-2-ynyl)benzeneamine oxide Traditional Name: N-ethyl-N-(4-hydroxybut-2-ynyl)benzeneamine oxide Formula: C12H15NO2 MolecularWeight: 205.253

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CC#CCO)(C1=CC=CC=C1)[O-]

Isomeric SMILES

CC[N+](CC#CCO)(C1=CC=CC=C1)[O-]

InChI

InChI=1S/C12H15NO2/c1-2-13(15,10-6-7-11-14)12-8-4-3-5-9-12/h3-5,8-9,14H,2,10-11H2,1H3