(2-butyl-4-iodanyl-phenyl)methyl hydrogen carbonate

Systemtic Name: (2-butyl-4-iodanyl-phenyl)methyl hydrogen carbonate Openeye Name: (2-butyl-4-iodo-phenyl)methyl hydrogen carbonate CAS Name: carbonic acid (2-butyl-4-iodophenyl)methyl ester IUPAC Name: (2-butyl-4-iodophenyl)methyl hydrogen carbonate Traditional Name: carbonic acid (2-butyl-4-iodo-benzyl) ester Formula: C12H15IO3 MolecularWeight: 334.15017

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=CC(=C1)I)COC(=O)O

Isomeric SMILES

CCCCC1=C(C=CC(=C1)I)COC(=O)O

InChI

InChI=1S/C12H15IO3/c1-2-3-4-9-7-11(13)6-5-10(9)8-16-12(14)15/h5-7H,2-4,8H2,1H3,(H,14,15)