2-phenoxyethanoate; trimethyl(phenyl)azanium

Systemtic Name: 2-phenoxyethanoate; trimethyl(phenyl)azanium Openeye Name: 2-phenoxyacetate; trimethyl(phenyl)ammonium CAS Name: 2-phenoxyacetate; trimethyl(phenyl)ammonium IUPAC Name: 2-phenoxyacetate; trimethyl(phenyl)azanium Traditional Name: 2-phenoxyacetate; trimethyl(phenyl)ammonium Formula: C17H21NO3 MolecularWeight: 287.35354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)C1=CC=CC=C1.C1=CC=C(C=C1)OCC(=O)[O-]

Isomeric SMILES

C[N+](C)(C)C1=CC=CC=C1.C1=CC=C(C=C1)OCC(=O)[O-]

InChI

InChI=1S/C9H14N.C8H8O3/c1-10(2,3)9-7-5-4-6-8-9;9-8(10)6-11-7-4-2-1-3-5-7/h4-8H,1-3H3;1-5H,6H2,(H,9,10)/q+1;/p-1