(3-carboxy-2-ethoxy-4-oxidanylidene-4-pyridin-3-yl-butyl)-trimethyl-azanium

Systemtic Name: (3-carboxy-2-ethoxy-4-oxidanylidene-4-pyridin-3-yl-butyl)-trimethyl-azanium Openeye Name: [3-carboxy-2-ethoxy-4-oxo-4-(3-pyridyl)butyl]-trimethyl-ammonium CAS Name: [3-carboxy-2-ethoxy-4-oxo-4-(3-pyridinyl)butyl]-trimethylammonium IUPAC Name: (3-carboxy-2-ethoxy-4-oxo-4-pyridin-3-ylbutyl)-trimethylazanium Traditional Name: [3-carboxy-2-ethoxy-4-keto-4-(3-pyridyl)butyl]-trimethyl-ammonium Formula: C15H23N2O4+ MolecularWeight: 295.35412

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C[N+](C)(C)C)C(C(=O)C1=CN=CC=C1)C(=O)O

Isomeric SMILES

CCOC(C[N+](C)(C)C)C(C(=O)C1=CN=CC=C1)C(=O)O

InChI

InChI=1S/C15H22N2O4/c1-5-21-12(10-17(2,3)4)13(15(19)20)14(18)11-7-6-8-16-9-11/h6-9,12-13H,5,10H2,1-4H3/p+1