1-(5-ethoxy-2,4-dimethyl-5-oxidanylidene-pentanoyl)-2,3-dihydroindol-1-ium-1-carboxylic acid

Systemtic Name: 1-(5-ethoxy-2,4-dimethyl-5-oxidanylidene-pentanoyl)-2,3-dihydroindol-1-ium-1-carboxylic acid Openeye Name: 1-(5-ethoxy-2,4-dimethyl-5-oxo-pentanoyl)indolin-1-ium-1-carboxylic acid CAS Name: 1-(5-ethoxy-2,4-dimethyl-1,5-dioxopentyl)-2,3-dihydroindol-1-ium-1-carboxylic acid IUPAC Name: 1-(5-ethoxy-2,4-dimethyl-5-oxopentanoyl)-2,3-dihydroindol-1-ium-1-carboxylic acid Traditional Name: 1-(5-ethoxy-5-keto-2,4-dimethyl-pentanoyl)indolin-1-ium-1-carboxylic acid Formula: C18H24NO5+ MolecularWeight: 334.38686

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)CC(C)C(=O)[N+]1(CCC2=CC=CC=C21)C(=O)O

Isomeric SMILES

CCOC(=O)C(C)CC(C)C(=O)[N+]1(CCC2=CC=CC=C21)C(=O)O

InChI

InChI=1S/C18H23NO5/c1-4-24-17(21)13(3)11-12(2)16(20)19(18(22)23)10-9-14-7-5-6-8-15(14)19/h5-8,12-13H,4,9-11H2,1-3H3/p+1