[(2R)-1-imidazol-1-yl-3-(4-iodanylphenoxy)propan-2-yl] 4-iodanylbenzoate

Systemtic Name: [(2R)-1-imidazol-1-yl-3-(4-iodanylphenoxy)propan-2-yl] 4-iodanylbenzoate Openeye Name: [(1R)-1-(imidazol-1-ylmethyl)-2-(4-iodophenoxy)ethyl] 4-iodobenzoate CAS Name: 4-iodobenzoic acid [(2R)-1-(1-imidazolyl)-3-(4-iodophenoxy)propan-2-yl] ester IUPAC Name: [(2R)-1-imidazol-1-yl-3-(4-iodophenoxy)propan-2-yl] 4-iodobenzoate Traditional Name: 4-iodobenzoic acid [(1R)-1-(imidazol-1-ylmethyl)-2-(4-iodophenoxy)ethyl] ester Formula: C19H16I2N2O3 MolecularWeight: 574.15088

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)OC(CN2C=CN=C2)COC3=CC=C(C=C3)I)I

Isomeric SMILES

C1=CC(=CC=C1C(=O)O[C@H](CN2C=CN=C2)COC3=CC=C(C=C3)I)I

InChI

InChI=1S/C19H16I2N2O3/c20-15-3-1-14(2-4-15)19(24)26-18(11-23-10-9-22-13-23)12-25-17-7-5-16(21)6-8-17/h1-10,13,18H,11-12H2/t18-/m1/s1