2-[5-fluoranyl-1,1-dimethyl-2-(5-methyl-3-phenyl-1,2-oxazol-4-yl)indol-1-ium-3-yl]-2-oxidanylidene-ethanamide

Systemtic Name: 2-[5-fluoranyl-1,1-dimethyl-2-(5-methyl-3-phenyl-1,2-oxazol-4-yl)indol-1-ium-3-yl]-2-oxidanylidene-ethanamide Openeye Name: 2-[5-fluoro-1,1-dimethyl-2-(5-methyl-3-phenyl-isoxazol-4-yl)indol-1-ium-3-yl]-2-oxo-acetamide CAS Name: 2-[5-fluoro-1,1-dimethyl-2-(5-methyl-3-phenyl-4-isoxazolyl)-3-indol-1-iumyl]-2-oxoacetamide IUPAC Name: 2-[5-fluoro-1,1-dimethyl-2-(5-methyl-3-phenyl-1,2-oxazol-4-yl)indol-1-ium-3-yl]-2-oxoacetamide Traditional Name: 2-[5-fluoro-1,1-dimethyl-2-(5-methyl-3-phenyl-isoxazol-4-yl)indol-1-ium-3-yl]-2-keto-acetamide Formula: C22H19FN3O3+ MolecularWeight: 392.402963

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2)C3=C(C4=C([N+]3(C)C)C=CC(=C4)F)C(=O)C(=O)N

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2)C3=C(C4=C([N+]3(C)C)C=CC(=C4)F)C(=O)C(=O)N

InChI

InChI=1S/C22H18FN3O3/c1-12-17(19(25-29-12)13-7-5-4-6-8-13)20-18(21(27)22(24)28)15-11-14(23)9-10-16(15)26(20,2)3/h4-11H,1-3H3,(H-,24,28)/p+1