2-[bis(2-iodanylethyl)amino]-N-(2-hydroxyethyl)-3,5-dinitro-N-propyl-benzamide

Systemtic Name: 2-[bis(2-iodanylethyl)amino]-N-(2-hydroxyethyl)-3,5-dinitro-N-propyl-benzamide Openeye Name: 2-[bis(2-iodoethyl)amino]-N-(2-hydroxyethyl)-3,5-dinitro-N-propyl-benzamide CAS Name: 2-[bis(2-iodoethyl)amino]-N-(2-hydroxyethyl)-3,5-dinitro-N-propylbenzamide IUPAC Name: 2-[bis(2-iodoethyl)amino]-N-(2-hydroxyethyl)-3,5-dinitro-N-propylbenzamide Traditional Name: 2-[bis(2-iodoethyl)amino]-N-(2-hydroxyethyl)-3,5-dinitro-N-propyl-benzamide Formula: C16H22I2N4O6 MolecularWeight: 620.17802

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCO)C(=O)C1=CC(=CC(=C1N(CCI)CCI)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCCN(CCO)C(=O)C1=CC(=CC(=C1N(CCI)CCI)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H22I2N4O6/c1-2-5-20(8-9-23)16(24)13-10-12(21(25)26)11-14(22(27)28)15(13)19(6-3-17)7-4-18/h10-11,23H,2-9H2,1H3