2,3-bis(oxidanylidene)-1-(2-propan-2-yloxyethyl)indol-1-ium-1-carboxylic acid

Systemtic Name: 2,3-bis(oxidanylidene)-1-(2-propan-2-yloxyethyl)indol-1-ium-1-carboxylic acid Openeye Name: 1-(2-isopropoxyethyl)-2,3-dioxo-indolin-1-ium-1-carboxylic acid CAS Name: 2,3-dioxo-1-(2-propan-2-yloxyethyl)-1-indol-1-iumcarboxylic acid IUPAC Name: 2,3-dioxo-1-(2-propan-2-yloxyethyl)indol-1-ium-1-carboxylic acid Traditional Name: 1-(2-isopropoxyethyl)-2,3-diketo-indolin-1-ium-1-carboxylic acid Formula: C14H16NO5+ MolecularWeight: 278.28054

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCC[N+]1(C2=CC=CC=C2C(=O)C1=O)C(=O)O

Isomeric SMILES

CC(C)OCC[N+]1(C2=CC=CC=C2C(=O)C1=O)C(=O)O

InChI

InChI=1S/C14H15NO5/c1-9(2)20-8-7-15(14(18)19)11-6-4-3-5-10(11)12(16)13(15)17/h3-6,9H,7-8H2,1-2H3/p+1