3-iodyl-4,5-dinitro-naphthalene-2-carboxylic acid

Systemtic Name: 3-iodyl-4,5-dinitro-naphthalene-2-carboxylic acid Openeye Name: 3-iodyl-4,5-dinitro-naphthalene-2-carboxylic acid CAS Name: 3-iodyl-4,5-dinitro-2-naphthalenecarboxylic acid IUPAC Name: 3-iodyl-4,5-dinitronaphthalene-2-carboxylic acid Traditional Name: 3-iodyl-4,5-dinitro-2-naphthoic acid Formula: C11H5IN2O8 MolecularWeight: 420.07047

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=CC(=C(C(=C2C(=C1)[N+](=O)[O-])[N+](=O)[O-])I(=O)=O)C(=O)O

Isomeric SMILES

C1=CC2=CC(=C(C(=C2C(=C1)[N+](=O)[O-])[N+](=O)[O-])I(=O)=O)C(=O)O

InChI

InChI=1S/C11H5IN2O8/c15-11(16)6-4-5-2-1-3-7(13(19)20)8(5)10(14(21)22)9(6)12(17)18/h1-4H,(H,15,16)