2-butan-2-yl-1-oxidanidyl-indol-1-ium-3-one

Systemtic Name: 2-butan-2-yl-1-oxidanidyl-indol-1-ium-3-one Openeye Name: 1-oxido-2-sec-butyl-indol-1-ium-3-one CAS Name: 2-butan-2-yl-1-oxido-3-indol-1-iumone IUPAC Name: 2-butan-2-yl-1-oxidoindol-1-ium-3-one Traditional Name: 1-oxido-2-sec-butyl-indol-1-ium-3-one Formula: C12H13NO2 MolecularWeight: 203.23712

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=[N+](C2=CC=CC=C2C1=O)[O-]

Isomeric SMILES

CCC(C)C1=[N+](C2=CC=CC=C2C1=O)[O-]

InChI

InChI=1S/C12H13NO2/c1-3-8(2)11-12(14)9-6-4-5-7-10(9)13(11)15/h4-8H,3H2,1-2H3