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

Systemtic Name: 2-(2-hydroxyphenyl)carbonyl-3-oxidanyl-4-(trimethylazaniumyl)butanoate hydrochloride Openeye Name: 3-hydroxy-2-(2-hydroxybenzoyl)-4-(trimethylammonio)butanoate hydrochloride CAS Name: 3-hydroxy-2-[(2-hydroxyphenyl)-oxomethyl]-4-(trimethylammonio)butanoate hydrochloride IUPAC Name: 3-hydroxy-2-(2-hydroxybenzoyl)-4-(trimethylazaniumyl)butanoate hydrochloride Traditional Name: 3-hydroxy-2-salicyloyl-4-(trimethylammonio)butyrate hydrochloride Formula: C14H20ClNO5 MolecularWeight: 317.7653

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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.Cl

Isomeric SMILES

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

InChI

InChI=1S/C14H19NO5.ClH/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);1H