3-methyl-3-octyl-2H-1,3-benzoxazol-3-ium

Systemtic Name: 3-methyl-3-octyl-2H-1,3-benzoxazol-3-ium Openeye Name: 3-methyl-3-octyl-2H-1,3-benzoxazol-3-ium CAS Name: 3-methyl-3-octyl-2H-1,3-benzoxazol-3-ium IUPAC Name: 3-methyl-3-octyl-2H-1,3-benzoxazol-3-ium Traditional Name: 3-methyl-3-octyl-2H-1,3-benzoxazol-3-ium Formula: C16H26NO+ MolecularWeight: 248.38374

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[N+]1(COC2=CC=CC=C21)C

Isomeric SMILES

CCCCCCCC[N+]1(COC2=CC=CC=C21)C

InChI

InChI=1S/C16H26NO/c1-3-4-5-6-7-10-13-17(2)14-18-16-12-9-8-11-15(16)17/h8-9,11-12H,3-7,10,13-14H2,1-2H3/q+1