[2-methyl-3-(phenylmethyl)icosan-2-yl]azanium

Systemtic Name: [2-methyl-3-(phenylmethyl)icosan-2-yl]azanium Openeye Name: (2-benzyl-1,1-dimethyl-nonadecyl)ammonium CAS Name: [2-methyl-3-(phenylmethyl)eicosan-2-yl]ammonium IUPAC Name: (3-benzyl-2-methylicosan-2-yl)azanium Traditional Name: (2-benzyl-1,1-dimethyl-nonadecyl)ammonium Formula: C28H52N+ MolecularWeight: 402.71918

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(CC1=CC=CC=C1)C(C)(C)[NH3+]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(CC1=CC=CC=C1)C(C)(C)[NH3+]

InChI

InChI=1S/C28H51N/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-24-27(28(2,3)29)25-26-22-19-18-20-23-26/h18-20,22-23,27H,4-17,21,24-25,29H2,1-3H3/p+1