2-(3,4-dimethoxyphenyl)-N-methyl-ethanamine; N-[4-ethoxy-3,5-bis(iodanyl)phenyl]methanesulfonamide

Systemtic Name: 2-(3,4-dimethoxyphenyl)-N-methyl-ethanamine; N-[4-ethoxy-3,5-bis(iodanyl)phenyl]methanesulfonamide Openeye Name: 2-(3,4-dimethoxyphenyl)-N-methyl-ethanamine; N-(4-ethoxy-3,5-diiodo-phenyl)methanesulfonamide CAS Name: 2-(3,4-dimethoxyphenyl)-N-methylethanamine; N-(4-ethoxy-3,5-diiodophenyl)methanesulfonamide IUPAC Name: 2-(3,4-dimethoxyphenyl)-N-methylethanamine; N-(4-ethoxy-3,5-diiodophenyl)methanesulfonamide Traditional Name: N-(4-ethoxy-3,5-diiodo-phenyl)methanesulfonamide; homoveratryl(methyl)amine Formula: C20H28I2N2O5S MolecularWeight: 662.32066

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1I)NS(=O)(=O)C)I.CNCCC1=CC(=C(C=C1)OC)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1I)NS(=O)(=O)C)I.CNCCC1=CC(=C(C=C1)OC)OC

InChI

InChI=1S/C11H17NO2.C9H11I2NO3S/c1-12-7-6-9-4-5-10(13-2)11(8-9)14-3;1-3-15-9-7(10)4-6(5-8(9)11)12-16(2,13)14/h4-5,8,12H,6-7H2,1-3H3;4-5,12H,3H2,1-2H3