3-(2-phenylethanoyloxy)-4-(trimethylazaniumyl)butanoate

Systemtic Name: 3-(2-phenylethanoyloxy)-4-(trimethylazaniumyl)butanoate Openeye Name: 3-(2-phenylacetyl)oxy-4-(trimethylammonio)butanoate CAS Name: 3-(1-oxo-2-phenylethoxy)-4-(trimethylammonio)butanoate IUPAC Name: 3-(2-phenylacetyl)oxy-4-(trimethylazaniumyl)butanoate Traditional Name: 3-(2-phenylacetyl)oxy-4-(trimethylammonio)butyrate Formula: C15H21NO4 MolecularWeight: 279.33154

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC(CC(=O)[O-])OC(=O)CC1=CC=CC=C1

Isomeric SMILES

C[N+](C)(C)CC(CC(=O)[O-])OC(=O)CC1=CC=CC=C1

InChI

InChI=1S/C15H21NO4/c1-16(2,3)11-13(10-14(17)18)20-15(19)9-12-7-5-4-6-8-12/h4-8,13H,9-11H2,1-3H3