2-[[ethyl(2-methylprop-2-enyl)azaniumyl]methyl]-4,6-bis(iodanyl)phenolate

Systemtic Name: 2-[[ethyl(2-methylprop-2-enyl)azaniumyl]methyl]-4,6-bis(iodanyl)phenolate Openeye Name: 2-[[ethyl(2-methylallyl)ammonio]methyl]-4,6-diiodo-phenolate CAS Name: 2-[[ethyl(2-methylprop-2-enyl)ammonio]methyl]-4,6-diiodophenolate IUPAC Name: 2-[[ethyl(2-methylprop-2-enyl)azaniumyl]methyl]-4,6-diiodophenolate Traditional Name: 2-[[ethyl(2-methylallyl)ammonio]methyl]-4,6-diiodo-phenolate Formula: C13H17I2NO MolecularWeight: 457.08912

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17I2NO/c1-4-16(7-9(2)3)8-10-5-11(14)6-12(15)13(10)17/h5-6,17H,2,4,7-8H2,1,3H3