1-[3-[2,4-bis(iodanyl)phenyl]-3-phenyl-oxiran-2-yl]imidazole; ethanedioic acid

Systemtic Name: 1-[3-[2,4-bis(iodanyl)phenyl]-3-phenyl-oxiran-2-yl]imidazole; ethanedioic acid Openeye Name: 1-[3-(2,4-diiodophenyl)-3-phenyl-oxiran-2-yl]imidazole; oxalic acid CAS Name: 1-[3-(2,4-diiodophenyl)-3-phenyl-2-oxiranyl]imidazole; oxalic acid IUPAC Name: 1-[3-(2,4-diiodophenyl)-3-phenyloxiran-2-yl]imidazole; oxalic acid Traditional Name: 1-[3-(2,4-diiodophenyl)-3-phenyl-oxiran-2-yl]imidazole; oxalic acid Formula: C19H14I2N2O5 MolecularWeight: 604.1338

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2(C(O2)N3C=CN=C3)C4=C(C=C(C=C4)I)I.C(=O)(C(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)C2(C(O2)N3C=CN=C3)C4=C(C=C(C=C4)I)I.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H12I2N2O.C2H2O4/c18-13-6-7-14(15(19)10-13)17(12-4-2-1-3-5-12)16(22-17)21-9-8-20-11-21;3-1(4)2(5)6/h1-11,16H;(H,3,4)(H,5,6)