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

Systemtic Name: [2-methyl-3-(phenylmethyl)octadecan-2-yl]azanium Openeye Name: (2-benzyl-1,1-dimethyl-heptadecyl)ammonium CAS Name: [2-methyl-3-(phenylmethyl)octadecan-2-yl]ammonium IUPAC Name: (3-benzyl-2-methyloctadecan-2-yl)azanium Traditional Name: (2-benzyl-1,1-dimethyl-heptadecyl)ammonium Formula: C26H48N+ MolecularWeight: 374.66602

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H47N/c1-4-5-6-7-8-9-10-11-12-13-14-15-19-22-25(26(2,3)27)23-24-20-17-16-18-21-24/h16-18,20-21,25H,4-15,19,22-23,27H2,1-3H3/p+1