[4-(diethylamino)-3-methyl-butan-2-yl] 5-methyl-1-benzofuran-2-carboxylate; iodanylethane

Systemtic Name: [4-(diethylamino)-3-methyl-butan-2-yl] 5-methyl-1-benzofuran-2-carboxylate; iodanylethane Openeye Name: [3-(diethylamino)-1,2-dimethyl-propyl] 5-methylbenzofuran-2-carboxylate; iodoethane CAS Name: iodoethane; 5-methyl-2-benzofurancarboxylic acid [4-(diethylamino)-3-methylbutan-2-yl] ester IUPAC Name: [4-(diethylamino)-3-methylbutan-2-yl] 5-methyl-1-benzofuran-2-carboxylate; iodoethane Traditional Name: iodoethane; 5-methylcoumarilic acid [3-(diethylamino)-1,2-dimethyl-propyl] ester Formula: C21H32INO3 MolecularWeight: 473.38815

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC(C)C(C)OC(=O)C1=CC2=C(O1)C=CC(=C2)C.CCI

Isomeric SMILES

CCN(CC)CC(C)C(C)OC(=O)C1=CC2=C(O1)C=CC(=C2)C.CCI

InChI

InChI=1S/C19H27NO3.C2H5I/c1-6-20(7-2)12-14(4)15(5)22-19(21)18-11-16-10-13(3)8-9-17(16)23-18;1-2-3/h8-11,14-15H,6-7,12H2,1-5H3;2H2,1H3