N-(4-iodanyl-2,5-dimethyl-phenyl)-3-nitro-benzamide

Systemtic Name: N-(4-iodanyl-2,5-dimethyl-phenyl)-3-nitro-benzamide Openeye Name: N-(4-iodo-2,5-dimethyl-phenyl)-3-nitro-benzamide CAS Name: N-(4-iodo-2,5-dimethylphenyl)-3-nitrobenzamide IUPAC Name: N-(4-iodo-2,5-dimethylphenyl)-3-nitrobenzamide Traditional Name: N-(4-iodo-2,5-dimethyl-phenyl)-3-nitro-benzamide Formula: C15H13IN2O3 MolecularWeight: 396.17979

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1I)C)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1I)C)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H13IN2O3/c1-9-7-14(10(2)6-13(9)16)17-15(19)11-4-3-5-12(8-11)18(20)21/h3-8H,1-2H3,(H,17,19)