iodosylbenzene; 4-methylbenzoate

Systemtic Name: iodosylbenzene; 4-methylbenzoate Openeye Name: iodosylbenzene; 4-methylbenzoate CAS Name: iodosylbenzene; 4-methylbenzoate IUPAC Name: iodosylbenzene; 4-methylbenzoate Traditional Name: iodosylbenzene; 4-methylbenzoate Formula: C22H19IO5-2 MolecularWeight: 490.28773

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)[O-].CC1=CC=C(C=C1)C(=O)[O-].C1=CC=C(C=C1)I=O

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)[O-].CC1=CC=C(C=C1)C(=O)[O-].C1=CC=C(C=C1)I=O

InChI

InChI=1S/2C8H8O2.C6H5IO/c2*1-6-2-4-7(5-3-6)8(9)10;8-7-6-4-2-1-3-5-6/h2*2-5H,1H3,(H,9,10);1-5H/p-2