2-[3-carboxy-4,5-bis(oxidanyl)phenoxy]ethyl-trimethyl-azanium

Systemtic Name: 2-[3-carboxy-4,5-bis(oxidanyl)phenoxy]ethyl-trimethyl-azanium Openeye Name: 2-(3-carboxy-4,5-dihydroxy-phenoxy)ethyl-trimethyl-ammonium CAS Name: 2-(3-carboxy-4,5-dihydroxyphenoxy)ethyl-trimethylammonium IUPAC Name: 2-(3-carboxy-4,5-dihydroxyphenoxy)ethyl-trimethylazanium Traditional Name: 2-(3-carboxy-4,5-dihydroxy-phenoxy)ethyl-trimethyl-ammonium Formula: C12H18NO5+ MolecularWeight: 256.27502

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCOC1=CC(=C(C(=C1)C(=O)O)O)O

Isomeric SMILES

C[N+](C)(C)CCOC1=CC(=C(C(=C1)C(=O)O)O)O

InChI

InChI=1S/C12H17NO5/c1-13(2,3)4-5-18-8-6-9(12(16)17)11(15)10(14)7-8/h6-7H,4-5H2,1-3H3,(H2-,14,15,16,17)/p+1