2-(2-hydroxyphenyl)carbonyl-3-oxidanyl-4-(trimethylazaniumyl)butanoate

Systemtic Name: 2-(2-hydroxyphenyl)carbonyl-3-oxidanyl-4-(trimethylazaniumyl)butanoate Openeye Name: 3-hydroxy-2-(2-hydroxybenzoyl)-4-(trimethylammonio)butanoate CAS Name: 3-hydroxy-2-[(2-hydroxyphenyl)-oxomethyl]-4-(trimethylammonio)butanoate IUPAC Name: 3-hydroxy-2-(2-hydroxybenzoyl)-4-(trimethylazaniumyl)butanoate Traditional Name: 3-hydroxy-2-salicyloyl-4-(trimethylammonio)butyrate Formula: C14H19NO5 MolecularWeight: 281.30436

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC(C(C(=O)C1=CC=CC=C1O)C(=O)[O-])O

Isomeric SMILES

C[N+](C)(C)CC(C(C(=O)C1=CC=CC=C1O)C(=O)[O-])O

InChI

InChI=1S/C14H19NO5/c1-15(2,3)8-11(17)12(14(19)20)13(18)9-6-4-5-7-10(9)16/h4-7,11-12,17H,8H2,1-3H3,(H-,16,18,19,20)