[2-methyl-3-(phenylmethyl)pentadecan-2-yl]azanium ethanoate

Systemtic Name: [2-methyl-3-(phenylmethyl)pentadecan-2-yl]azanium ethanoate Openeye Name: (2-benzyl-1,1-dimethyl-tetradecyl)ammonium acetate CAS Name: [2-methyl-3-(phenylmethyl)pentadecan-2-yl]ammonium acetate IUPAC Name: (3-benzyl-2-methylpentadecan-2-yl)azanium acetate Traditional Name: (2-benzyl-1,1-dimethyl-tetradecyl)ammonium acetate Formula: C25H45NO2 MolecularWeight: 391.6303

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(CC1=CC=CC=C1)C(C)(C)[NH3+].CC(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCC(CC1=CC=CC=C1)C(C)(C)[NH3+].CC(=O)[O-]

InChI

InChI=1S/C23H41N.C2H4O2/c1-4-5-6-7-8-9-10-11-12-16-19-22(23(2,3)24)20-21-17-14-13-15-18-21;1-2(3)4/h13-15,17-18,22H,4-12,16,19-20,24H2,1-3H3;1H3,(H,3,4)