1-ethenyl-1-methyl-2-(phenylmethyl)-1-azoniacyclotridecane

Systemtic Name: 1-ethenyl-1-methyl-2-(phenylmethyl)-1-azoniacyclotridecane Openeye Name: 2-benzyl-1-methyl-1-vinyl-azoniacyclotridecane CAS Name: 1-ethenyl-1-methyl-2-(phenylmethyl)-azoniacyclotridecane IUPAC Name: 2-benzyl-1-ethenyl-1-methyl-azoniacyclotridecane Traditional Name: 2-benzyl-1-methyl-1-vinyl-azoniacyclotridecane Formula: C22H36N+ MolecularWeight: 314.52794

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCCCCCCCCCC1CC2=CC=CC=C2)C=C

Isomeric SMILES

C[N+]1(CCCCCCCCCCCC1CC2=CC=CC=C2)C=C

InChI

InChI=1S/C22H36N/c1-3-23(2)19-15-10-8-6-4-5-7-9-14-18-22(23)20-21-16-12-11-13-17-21/h3,11-13,16-17,22H,1,4-10,14-15,18-20H2,2H3/q+1