4-(diethylamino)butan-2-yl 3,4-dihydro-1H-isochromene-1-carboxylate; iodanylmethane

Systemtic Name: 4-(diethylamino)butan-2-yl 3,4-dihydro-1H-isochromene-1-carboxylate; iodanylmethane Openeye Name: [3-(diethylamino)-1-methyl-propyl] isochromane-1-carboxylate; iodomethane CAS Name: 3,4-dihydro-1H-2-benzopyran-1-carboxylic acid 4-(diethylamino)butan-2-yl ester; iodomethane IUPAC Name: 4-(diethylamino)butan-2-yl 3,4-dihydro-1H-isochromene-1-carboxylate; iodomethane Traditional Name: iodomethane; isochroman-1-carboxylic acid [3-(diethylamino)-1-methyl-propyl] ester Formula: C20H33I2NO3 MolecularWeight: 589.28986

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCC(C)OC(=O)C1C2=CC=CC=C2CCO1.CI.CI

Isomeric SMILES

CCN(CC)CCC(C)OC(=O)C1C2=CC=CC=C2CCO1.CI.CI

InChI

InChI=1S/C18H27NO3.2CH3I/c1-4-19(5-2)12-10-14(3)22-18(20)17-16-9-7-6-8-15(16)11-13-21-17;2*1-2/h6-9,14,17H,4-5,10-13H2,1-3H3;2*1H3