methyl 3-[[2,5-bis(iodanyl)phenyl]carbonylamino]-4-morpholin-4-yl-benzoate

Systemtic Name: methyl 3-[[2,5-bis(iodanyl)phenyl]carbonylamino]-4-morpholin-4-yl-benzoate Openeye Name: methyl 3-[(2,5-diiodobenzoyl)amino]-4-morpholino-benzoate CAS Name: 3-[[(2,5-diiodophenyl)-oxomethyl]amino]-4-(4-morpholinyl)benzoic acid methyl ester IUPAC Name: methyl 3-[(2,5-diiodobenzoyl)amino]-4-morpholin-4-ylbenzoate Traditional Name: 3-[(2,5-diiodobenzoyl)amino]-4-morpholino-benzoic acid methyl ester Formula: C19H18I2N2O4 MolecularWeight: 592.16616

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)N2CCOCC2)NC(=O)C3=C(C=CC(=C3)I)I

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)N2CCOCC2)NC(=O)C3=C(C=CC(=C3)I)I

InChI

InChI=1S/C19H18I2N2O4/c1-26-19(25)12-2-5-17(23-6-8-27-9-7-23)16(10-12)22-18(24)14-11-13(20)3-4-15(14)21/h2-5,10-11H,6-9H2,1H3,(H,22,24)