N-[3-[dimethyl-(phenylmethyl)azaniumyl]-2,2-dimethyl-propyl]dodecanimidate hydrobromide

Systemtic Name: N-[3-[dimethyl-(phenylmethyl)azaniumyl]-2,2-dimethyl-propyl]dodecanimidate hydrobromide Openeye Name: N-[3-[benzyl(dimethyl)ammonio]-2,2-dimethyl-propyl]dodecanimidate hydrobromide CAS Name: N-[3-[dimethyl-(phenylmethyl)ammonio]-2,2-dimethylpropyl]dodecanimidate hydrobromide IUPAC Name: N-[3-[benzyl(dimethyl)azaniumyl]-2,2-dimethylpropyl]dodecanimidate hydrobromide Traditional Name: N-[3-[benzyl(dimethyl)ammonio]-2,2-dimethyl-propyl]laurimidate hydrobromide Formula: C26H47BrN2O MolecularWeight: 483.56818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=NCC(C)(C)C[N+](C)(C)CC1=CC=CC=C1)[O-].Br

Isomeric SMILES

CCCCCCCCCCCC(=NCC(C)(C)C[N+](C)(C)CC1=CC=CC=C1)[O-].Br

InChI

InChI=1S/C26H46N2O.BrH/c1-6-7-8-9-10-11-12-13-17-20-25(29)27-22-26(2,3)23-28(4,5)21-24-18-15-14-16-19-24;/h14-16,18-19H,6-13,17,20-23H2,1-5H3;1H