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

Systemtic Name: [2-methyl-3-(phenylmethyl)tricosan-2-yl]azanium Openeye Name: (2-benzyl-1,1-dimethyl-docosyl)ammonium CAS Name: [2-methyl-3-(phenylmethyl)tricosan-2-yl]ammonium IUPAC Name: (3-benzyl-2-methyltricosan-2-yl)azanium Traditional Name: (2-benzyl-1,1-dimethyl-docosyl)ammonium Formula: C31H58N+ MolecularWeight: 444.79892

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H57N/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24-27-30(31(2,3)32)28-29-25-22-21-23-26-29/h21-23,25-26,30H,4-20,24,27-28,32H2,1-3H3/p+1