dodecyl-(2-methylnonan-2-yl)-phenoxycarbonyl-azanium chloride

Systemtic Name: dodecyl-(2-methylnonan-2-yl)-phenoxycarbonyl-azanium chloride Openeye Name: 1,1-dimethyloctyl-dodecyl-phenoxycarbonyl-ammonium chloride CAS Name: dodecyl-(2-methylnonan-2-yl)-[oxo(phenoxy)methyl]ammonium chloride IUPAC Name: dodecyl-(2-methylnonan-2-yl)-phenoxycarbonylazanium chloride Traditional Name: carbophenoxy-(1,1-dimethyloctyl)-lauryl-ammonium chloride Formula: C29H52ClNO2 MolecularWeight: 482.18168

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[NH+](C(=O)OC1=CC=CC=C1)C(C)(C)CCCCCCC.[Cl-]

Isomeric SMILES

CCCCCCCCCCCC[NH+](C(=O)OC1=CC=CC=C1)C(C)(C)CCCCCCC.[Cl-]

InChI

InChI=1S/C29H51NO2.ClH/c1-5-7-9-11-12-13-14-15-17-22-26-30(28(31)32-27-23-19-18-20-24-27)29(3,4)25-21-16-10-8-6-2;/h18-20,23-24H,5-17,21-22,25-26H2,1-4H3;1H