3-bromanyl-1-[[(4-iodophenyl)azaniumyl]methyl]-6,7,8,9-tetrahydrodibenzofuran-2-olate

Systemtic Name: 3-bromanyl-1-[[(4-iodophenyl)azaniumyl]methyl]-6,7,8,9-tetrahydrodibenzofuran-2-olate Openeye Name: 3-bromo-1-[[(4-iodophenyl)ammonio]methyl]-6,7,8,9-tetrahydrodibenzofuran-2-olate CAS Name: 3-bromo-1-[[(4-iodophenyl)ammonio]methyl]-6,7,8,9-tetrahydrodibenzofuran-2-olate IUPAC Name: 3-bromo-1-[[(4-iodophenyl)azaniumyl]methyl]-6,7,8,9-tetrahydrodibenzofuran-2-olate Traditional Name: 3-bromo-1-[[(4-iodophenyl)ammonio]methyl]-6,7,8,9-tetrahydrodibenzofuran-2-olate Formula: C19H17BrINO2 MolecularWeight: 498.15225

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C3=C(C(=C(C=C3O2)Br)[O-])C[NH2+]C4=CC=C(C=C4)I

Isomeric SMILES

C1CCC2=C(C1)C3=C(C(=C(C=C3O2)Br)[O-])C[NH2+]C4=CC=C(C=C4)I

InChI

InChI=1S/C19H17BrINO2/c20-15-9-17-18(13-3-1-2-4-16(13)24-17)14(19(15)23)10-22-12-7-5-11(21)6-8-12/h5-9,22-23H,1-4,10H2