2-iodyl-5-nitro-N-octadecanoyl-benzamide

Systemtic Name: 2-iodyl-5-nitro-N-octadecanoyl-benzamide Openeye Name: 2-iodyl-5-nitro-N-octadecanoyl-benzamide CAS Name: 2-iodyl-5-nitro-N-(1-oxooctadecyl)benzamide IUPAC Name: 2-iodyl-5-nitro-N-octadecanoylbenzamide Traditional Name: 2-iodyl-5-nitro-N-stearoyl-benzamide Formula: C25H39IN2O6 MolecularWeight: 590.49143

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H39IN2O6/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24(29)27-25(30)22-20-21(28(33)34)18-19-23(22)26(31)32/h18-20H,2-17H2,1H3,(H,27,29,30)