1-azanyl-1-cyclopropyl-6,7,8-tris(fluoranyl)-4-oxidanylidene-quinolin-1-ium-3-carboxylic acid

Systemtic Name: 1-azanyl-1-cyclopropyl-6,7,8-tris(fluoranyl)-4-oxidanylidene-quinolin-1-ium-3-carboxylic acid Openeye Name: 1-amino-1-cyclopropyl-6,7,8-trifluoro-4-oxo-quinolin-1-ium-3-carboxylic acid CAS Name: 1-amino-1-cyclopropyl-6,7,8-trifluoro-4-oxo-3-quinolin-1-iumcarboxylic acid IUPAC Name: 1-amino-1-cyclopropyl-6,7,8-trifluoro-4-oxoquinolin-1-ium-3-carboxylic acid Traditional Name: 1-amino-1-cyclopropyl-6,7,8-trifluoro-4-keto-quinolin-1-ium-3-carboxylic acid Formula: C13H10F3N2O3+ MolecularWeight: 299.22531

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1[N+]2(C=C(C(=O)C3=CC(=C(C(=C32)F)F)F)C(=O)O)N

Isomeric SMILES

C1CC1[N+]2(C=C(C(=O)C3=CC(=C(C(=C32)F)F)F)C(=O)O)N

InChI

InChI=1S/C13H9F3N2O3/c14-8-3-6-11(10(16)9(8)15)18(17,5-1-2-5)4-7(12(6)19)13(20)21/h3-5H,1-2,17H2/p+1