2-heptadecyl-3-methyl-4,5-dihydro-1,3-oxazol-3-ium

Systemtic Name: 2-heptadecyl-3-methyl-4,5-dihydro-1,3-oxazol-3-ium Openeye Name: 2-heptadecyl-3-methyl-4,5-dihydrooxazol-3-ium CAS Name: 2-heptadecyl-3-methyl-4,5-dihydrooxazol-3-ium IUPAC Name: 2-heptadecyl-3-methyl-4,5-dihydro-1,3-oxazol-3-ium Traditional Name: 2-heptadecyl-3-methyl-2-oxazolin-3-ium Formula: C21H42NO+ MolecularWeight: 324.56428

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC1=[N+](CCO1)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCC1=[N+](CCO1)C

InChI

InChI=1S/C21H42NO/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-22(2)19-20-23-21/h3-20H2,1-2H3/q+1