[4-(6-methylheptoxy)phenyl]-pyrazin-2-ylcarbonyl-iodanium

Systemtic Name: [4-(6-methylheptoxy)phenyl]-pyrazin-2-ylcarbonyl-iodanium Openeye Name: [4-(6-methylheptoxy)phenyl]-(pyrazine-2-carbonyl)iodonium CAS Name: [4-(6-methylheptoxy)phenyl]-[oxo(2-pyrazinyl)methyl]iodonium IUPAC Name: [4-(6-methylheptoxy)phenyl]-(pyrazine-2-carbonyl)iodanium Traditional Name: [4-(6-methylheptoxy)phenyl]-pyrazinoyl-iodonium Formula: C19H24IN2O2+ MolecularWeight: 439.31053

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCOC1=CC=C(C=C1)[I+]C(=O)C2=NC=CN=C2

Isomeric SMILES

CC(C)CCCCCOC1=CC=C(C=C1)[I+]C(=O)C2=NC=CN=C2

InChI

InChI=1S/C19H24IN2O2/c1-15(2)6-4-3-5-13-24-17-9-7-16(8-10-17)20-19(23)18-14-21-11-12-22-18/h7-12,14-15H,3-6,13H2,1-2H3/q+1