(1-imidazol-1-yl-3-methoxy-propan-2-yl) 4-iodanylbenzoate

Systemtic Name: (1-imidazol-1-yl-3-methoxy-propan-2-yl) 4-iodanylbenzoate Openeye Name: [1-(imidazol-1-ylmethyl)-2-methoxy-ethyl] 4-iodobenzoate CAS Name: 4-iodobenzoic acid [1-(1-imidazolyl)-3-methoxypropan-2-yl] ester IUPAC Name: (1-imidazol-1-yl-3-methoxypropan-2-yl) 4-iodobenzoate Traditional Name: 4-iodobenzoic acid [1-(imidazol-1-ylmethyl)-2-methoxy-ethyl] ester Formula: C14H15IN2O3 MolecularWeight: 386.18497

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Descriptors Computed from Structure

Canonical SMILES:

COCC(CN1C=CN=C1)OC(=O)C2=CC=C(C=C2)I

Isomeric SMILES

COCC(CN1C=CN=C1)OC(=O)C2=CC=C(C=C2)I

InChI

InChI=1S/C14H15IN2O3/c1-19-9-13(8-17-7-6-16-10-17)20-14(18)11-2-4-12(15)5-3-11/h2-7,10,13H,8-9H2,1H3