dimethyl-octadecyl-(phenylmethyl)chloranuidyl-azanium

Systemtic Name: dimethyl-octadecyl-(phenylmethyl)chloranuidyl-azanium Openeye Name: benzylchloranuidyl-dimethyl-octadecyl-ammonium CAS Name: dimethyl-octadecyl-(phenylmethyl)chloranuidylammonium IUPAC Name: benzylchloranuidyl-dimethyl-octadecylazanium Traditional Name: benzylchloranuidyl-dimethyl-stearyl-ammonium Formula: C27H50ClN MolecularWeight: 424.1456

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC[N+](C)(C)[Cl-]CC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCCCCCCC[N+](C)(C)[Cl-]CC1=CC=CC=C1

InChI

InChI=1S/C27H50ClN/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-25-29(2,3)28-26-27-23-20-19-21-24-27/h19-21,23-24H,4-18,22,25-26H2,1-3H3