dimethyl(11-phenylhenicosan-11-yl)azanium

Systemtic Name: dimethyl(11-phenylhenicosan-11-yl)azanium Openeye Name: (1-decyl-1-phenyl-undecyl)-dimethyl-ammonium CAS Name: dimethyl(11-phenylheneicosan-11-yl)ammonium IUPAC Name: dimethyl(11-phenylhenicosan-11-yl)azanium Traditional Name: (1-decyl-1-phenyl-undecyl)-dimethyl-ammonium Formula: C29H54N+ MolecularWeight: 416.74576

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(CCCCCCCCCC)(C1=CC=CC=C1)[NH+](C)C

Isomeric SMILES

CCCCCCCCCCC(CCCCCCCCCC)(C1=CC=CC=C1)[NH+](C)C

InChI

InChI=1S/C29H53N/c1-5-7-9-11-13-15-17-22-26-29(30(3)4,28-24-20-19-21-25-28)27-23-18-16-14-12-10-8-6-2/h19-21,24-25H,5-18,22-23,26-27H2,1-4H3/p+1