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(2-iodanyl-7-oxidanylidene-cyclohepta-1,3,5-trien-1-yl) 4-nitrobenzoate

(2-iodanyl-7-oxidanylidene-cyclohepta-1,3,5-trien-1-yl) 4-nitrobenzoate

Systemtic Name:(2-iodanyl-7-oxidanylidene-cyclohepta-1,3,5-trien-1-yl) 4-nitrobenzoate
Openeye Name:(2-iodo-7-oxo-cyclohepta-1,3,5-trien-1-yl) 4-nitrobenzoate
CAS Name:4-nitrobenzoic acid (2-iodo-7-oxo-1-cyclohepta-1,3,5-trienyl) ester
IUPAC Name:(2-iodo-7-oxocyclohepta-1,3,5-trien-1-yl) 4-nitrobenzoate
Traditional Name:4-nitrobenzoic acid (2-iodo-7-keto-cyclohepta-1,3,5-trien-1-yl) ester
Formula: C14H8INO5
MolecularWeight: 397.12149
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=O)C=C1)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-])I


Isomeric SMILES

C1=CC(=C(C(=O)C=C1)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-])I


InChI

InChI=1S/C14H8INO5/c15-11-3-1-2-4-12(17)13(11)21-14(18)9-5-7-10(8-6-9)16(19)20/h1-8H


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