3-[[3,5-bis(iodanyl)-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene]methylamino]oxybenzoic acid

Systemtic Name: 3-[[3,5-bis(iodanyl)-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene]methylamino]oxybenzoic acid Openeye Name: 3-[(3,5-diiodo-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]oxybenzoic acid CAS Name: 3-[(3,5-diiodo-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]oxybenzoic acid IUPAC Name: 3-[(3,5-diiodo-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]oxybenzoic acid Traditional Name: 3-[(3,5-diiodo-4-keto-cyclohexa-2,5-dien-1-ylidene)methylamino]oxybenzoic acid Formula: C14H9I2NO4 MolecularWeight: 509.0345

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)ONC=C2C=C(C(=O)C(=C2)I)I)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)ONC=C2C=C(C(=O)C(=C2)I)I)C(=O)O

InChI

InChI=1S/C14H9I2NO4/c15-11-4-8(5-12(16)13(11)18)7-17-21-10-3-1-2-9(6-10)14(19)20/h1-7,17H,(H,19,20)