4-(2-phenoxyethylazaniumyl)butanoate

Systemtic Name: 4-(2-phenoxyethylazaniumyl)butanoate Openeye Name: 4-(2-phenoxyethylammonio)butanoate CAS Name: 4-(2-phenoxyethylammonio)butanoate IUPAC Name: 4-(2-phenoxyethylazaniumyl)butanoate Traditional Name: 4-(2-phenoxyethylammonio)butyrate Formula: C12H17NO3 MolecularWeight: 223.26828

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC[NH2+]CCCC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OCC[NH2+]CCCC(=O)[O-]

InChI

InChI=1S/C12H17NO3/c14-12(15)7-4-8-13-9-10-16-11-5-2-1-3-6-11/h1-3,5-6,13H,4,7-10H2,(H,14,15)