2-iodanyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: 2-iodanyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide Openeye Name: 2-iodo-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide CAS Name: 2-iodo-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide IUPAC Name: 2-iodo-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide Traditional Name: 2-iodo-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide Formula: C14H8IN3O3S MolecularWeight: 425.20109

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])I

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])I

InChI

InChI=1S/C14H8IN3O3S/c15-10-4-2-1-3-9(10)13(19)17-14-16-11-6-5-8(18(20)21)7-12(11)22-14/h1-7H,(H,16,17,19)