5-chloranyl-1-ethyl-2,3-bis(oxidanylidene)indol-1-ium-1-carboxylic acid

Systemtic Name: 5-chloranyl-1-ethyl-2,3-bis(oxidanylidene)indol-1-ium-1-carboxylic acid Openeye Name: 5-chloro-1-ethyl-2,3-dioxo-indolin-1-ium-1-carboxylic acid CAS Name: 5-chloro-1-ethyl-2,3-dioxo-1-indol-1-iumcarboxylic acid IUPAC Name: 5-chloro-1-ethyl-2,3-dioxoindol-1-ium-1-carboxylic acid Traditional Name: 5-chloro-1-ethyl-2,3-diketo-indolin-1-ium-1-carboxylic acid Formula: C11H9ClNO4+ MolecularWeight: 254.64646

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H8ClNO4/c1-2-13(11(16)17)8-4-3-6(12)5-7(8)9(14)10(13)15/h3-5H,2H2,1H3/p+1