1,3-bis(dimethylamino)propan-2-yl 5-methyl-1-benzofuran-2-carboxylate; iodanylmethane

Systemtic Name: 1,3-bis(dimethylamino)propan-2-yl 5-methyl-1-benzofuran-2-carboxylate; iodanylmethane Openeye Name: [2-(dimethylamino)-1-(dimethylaminomethyl)ethyl] 5-methylbenzofuran-2-carboxylate; iodomethane CAS Name: iodomethane; 5-methyl-2-benzofurancarboxylic acid 1,3-bis(dimethylamino)propan-2-yl ester IUPAC Name: 1,3-bis(dimethylamino)propan-2-yl 5-methyl-1-benzofuran-2-carboxylate; iodomethane Traditional Name: iodomethane; 5-methylcoumarilic acid [2-(dimethylamino)-1-(dimethylaminomethyl)ethyl] ester Formula: C19H30I2N2O3 MolecularWeight: 588.26204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(=C2)C(=O)OC(CN(C)C)CN(C)C.CI.CI

Isomeric SMILES

CC1=CC2=C(C=C1)OC(=C2)C(=O)OC(CN(C)C)CN(C)C.CI.CI

InChI

InChI=1S/C17H24N2O3.2CH3I/c1-12-6-7-15-13(8-12)9-16(22-15)17(20)21-14(10-18(2)3)11-19(4)5;2*1-2/h6-9,14H,10-11H2,1-5H3;2*1H3