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

Systemtic Name: [2-methyl-3-(phenylmethyl)tridecan-2-yl]azanium Openeye Name: (2-benzyl-1,1-dimethyl-dodecyl)ammonium CAS Name: [2-methyl-3-(phenylmethyl)tridecan-2-yl]ammonium IUPAC Name: (3-benzyl-2-methyltridecan-2-yl)azanium Traditional Name: (2-benzyl-1,1-dimethyl-dodecyl)ammonium Formula: C21H38N+ MolecularWeight: 304.53312

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H37N/c1-4-5-6-7-8-9-10-14-17-20(21(2,3)22)18-19-15-12-11-13-16-19/h11-13,15-16,20H,4-10,14,17-18,22H2,1-3H3/p+1