2-(2-hydroxyethylazaniumyl)-4-(4-methoxyphenyl)-4-oxidanylidene-butanoate

Systemtic Name: 2-(2-hydroxyethylazaniumyl)-4-(4-methoxyphenyl)-4-oxidanylidene-butanoate Openeye Name: 2-(2-hydroxyethylammonio)-4-(4-methoxyphenyl)-4-oxo-butanoate CAS Name: 2-(2-hydroxyethylammonio)-4-(4-methoxyphenyl)-4-oxobutanoate IUPAC Name: 2-(2-hydroxyethylazaniumyl)-4-(4-methoxyphenyl)-4-oxobutanoate Traditional Name: 2-(2-hydroxyethylammonio)-4-keto-4-(4-methoxyphenyl)butyrate Formula: C13H17NO5 MolecularWeight: 267.27778

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)CC(C(=O)[O-])[NH2+]CCO

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)CC(C(=O)[O-])[NH2+]CCO

InChI

InChI=1S/C13H17NO5/c1-19-10-4-2-9(3-5-10)12(16)8-11(13(17)18)14-6-7-15/h2-5,11,14-15H,6-8H2,1H3,(H,17,18)