2-iodosyl-3,5-dinitro-N-octadecanoyl-benzamide; 2-iodosyl-5-[2-(2-methoxyethoxy)ethoxy]-N-octadecanoyl-benzamide

Systemtic Name: 2-iodosyl-3,5-dinitro-N-octadecanoyl-benzamide; 2-iodosyl-5-[2-(2-methoxyethoxy)ethoxy]-N-octadecanoyl-benzamide Openeye Name: 2-iodosyl-3,5-dinitro-N-octadecanoyl-benzamide; 2-iodosyl-5-[2-(2-methoxyethoxy)ethoxy]-N-octadecanoyl-benzamide CAS Name: 2-iodosyl-3,5-dinitro-N-(1-oxooctadecyl)benzamide; 2-iodosyl-5-[2-(2-methoxyethoxy)ethoxy]-N-(1-oxooctadecyl)benzamide IUPAC Name: 2-iodosyl-3,5-dinitro-N-octadecanoylbenzamide; 2-iodosyl-5-[2-(2-methoxyethoxy)ethoxy]-N-octadecanoylbenzamide Traditional Name: 2-iodosyl-3,5-dinitro-N-stearoyl-benzamide; 2-iodosyl-5-[2-(2-methoxyethoxy)ethoxy]-N-stearoyl-benzamide Formula: C55H88I2N4O13 MolecularWeight: 1267.11516

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NC(=O)C1=CC(=CC(=C1I=O)[N+](=O)[O-])[N+](=O)[O-].CCCCCCCCCCCCCCCCCC(=O)NC(=O)C1=C(C=CC(=C1)OCCOCCOC)I=O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)NC(=O)C1=CC(=CC(=C1I=O)[N+](=O)[O-])[N+](=O)[O-].CCCCCCCCCCCCCCCCCC(=O)NC(=O)C1=C(C=CC(=C1)OCCOCCOC)I=O

InChI

InChI=1S/C30H50INO6.C25H38IN3O7/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-29(33)32-30(34)27-25-26(19-20-28(27)31-35)38-24-23-37-22-21-36-2;1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23(30)27-25(31)21-18-20(28(33)34)19-22(29(35)36)24(21)26-32/h19-20,25H,3-18,21-24H2,1-2H3,(H,32,33,34);18-19H,2-17H2,1H3,(H,27,30,31)