(4-acetamidophenyl)carbonyl-(11-ethoxy-11-oxidanylidene-undecyl)-diethyl-azanium iodide

Systemtic Name: (4-acetamidophenyl)carbonyl-(11-ethoxy-11-oxidanylidene-undecyl)-diethyl-azanium iodide Openeye Name: (4-acetamidobenzoyl)-(11-ethoxy-11-oxo-undecyl)-diethyl-ammonium iodide CAS Name: [(4-acetamidophenyl)-oxomethyl]-(11-ethoxy-11-oxoundecyl)-diethylammonium iodide IUPAC Name: (4-acetamidobenzoyl)-(11-ethoxy-11-oxoundecyl)-diethylazanium iodide Traditional Name: (4-acetamidobenzoyl)-(11-ethoxy-11-keto-undecyl)-diethyl-ammonium iodide Formula: C26H43IN2O4 MolecularWeight: 574.53509

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CC)(CCCCCCCCCCC(=O)OCC)C(=O)C1=CC=C(C=C1)NC(=O)C.[I-]

Isomeric SMILES

CC[N+](CC)(CCCCCCCCCCC(=O)OCC)C(=O)C1=CC=C(C=C1)NC(=O)C.[I-]

InChI

InChI=1S/C26H42N2O4.HI/c1-5-28(6-2,26(31)23-17-19-24(20-18-23)27-22(4)29)21-15-13-11-9-8-10-12-14-16-25(30)32-7-3;/h17-20H,5-16,21H2,1-4H3;1H