[3-ethyl-4-(phenylmethyl)octadecan-3-yl]azanium chloride

Systemtic Name: [3-ethyl-4-(phenylmethyl)octadecan-3-yl]azanium chloride Openeye Name: (2-benzyl-1,1-diethyl-hexadecyl)ammonium chloride CAS Name: [3-ethyl-4-(phenylmethyl)octadecan-3-yl]ammonium chloride IUPAC Name: (4-benzyl-3-ethyloctadecan-3-yl)azanium chloride Traditional Name: (2-benzyl-1,1-diethyl-hexadecyl)ammonium chloride Formula: C27H50ClN MolecularWeight: 424.1456

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(CC1=CC=CC=C1)C(CC)(CC)[NH3+].[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCC(CC1=CC=CC=C1)C(CC)(CC)[NH3+].[Cl-]

InChI

InChI=1S/C27H49N.ClH/c1-4-7-8-9-10-11-12-13-14-15-16-20-23-26(27(28,5-2)6-3)24-25-21-18-17-19-22-25;/h17-19,21-22,26H,4-16,20,23-24,28H2,1-3H3;1H