2-diethylaminoethyl 5-methyl-1-benzofuran-2-carboxylate; iodanylethane

Systemtic Name: 2-diethylaminoethyl 5-methyl-1-benzofuran-2-carboxylate; iodanylethane Openeye Name: 2-diethylaminoethyl 5-methylbenzofuran-2-carboxylate; iodoethane CAS Name: iodoethane; 5-methyl-2-benzofurancarboxylic acid 2-diethylaminoethyl ester IUPAC Name: 2-diethylaminoethyl 5-methyl-1-benzofuran-2-carboxylate; iodoethane Traditional Name: iodoethane; 5-methylcoumarilic acid 2-diethylaminoethyl ester Formula: C18H26INO3 MolecularWeight: 431.30841

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21NO3.C2H5I/c1-4-17(5-2)8-9-19-16(18)15-11-13-10-12(3)6-7-14(13)20-15;1-2-3/h6-7,10-11H,4-5,8-9H2,1-3H3;2H2,1H3