4-bromanyl-3-methyl-5-(1-methylindol-1-ium-1-yl)-1,2-oxazole

Systemtic Name: 4-bromanyl-3-methyl-5-(1-methylindol-1-ium-1-yl)-1,2-oxazole Openeye Name: 4-bromo-3-methyl-5-(1-methylindol-1-ium-1-yl)isoxazole CAS Name: 4-bromo-3-methyl-5-(1-methyl-1-indol-1-iumyl)isoxazole IUPAC Name: 4-bromo-3-methyl-5-(1-methylindol-1-ium-1-yl)-1,2-oxazole Traditional Name: 4-bromo-3-methyl-5-(1-methylindol-1-ium-1-yl)isoxazole Formula: C13H12BrN2O+ MolecularWeight: 292.15118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1Br)[N+]2(C=CC3=CC=CC=C32)C

Isomeric SMILES

CC1=NOC(=C1Br)[N+]2(C=CC3=CC=CC=C32)C

InChI

InChI=1S/C13H12BrN2O/c1-9-12(14)13(17-15-9)16(2)8-7-10-5-3-4-6-11(10)16/h3-8H,1-2H3/q+1