azanium phenyl 2-ethylhexanoate

Systemtic Name: azanium phenyl 2-ethylhexanoate Openeye Name: ammonium phenyl 2-ethylhexanoate CAS Name: ammonium 2-ethylhexanoic acid phenyl ester IUPAC Name: azanium phenyl 2-ethylhexanoate Traditional Name: ammonium 2-ethylhexanoic acid phenyl ester Formula: C14H24NO2+ MolecularWeight: 238.34586

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)OC1=CC=CC=C1.[NH4+]

Isomeric SMILES

CCCCC(CC)C(=O)OC1=CC=CC=C1.[NH4+]

InChI

InChI=1S/C14H20O2.H3N/c1-3-5-9-12(4-2)14(15)16-13-10-7-6-8-11-13;/h6-8,10-12H,3-5,9H2,1-2H3;1H3/p+1