N,N-diethyl-2-[[1-(3-iodanylphenyl)-1,2,3,4-tetrahydroisoquinolin-6-yl]oxy]ethanamine

Systemtic Name: N,N-diethyl-2-[[1-(3-iodanylphenyl)-1,2,3,4-tetrahydroisoquinolin-6-yl]oxy]ethanamine Openeye Name: N,N-diethyl-2-[[1-(3-iodophenyl)-1,2,3,4-tetrahydroisoquinolin-6-yl]oxy]ethanamine CAS Name: N,N-diethyl-2-[[1-(3-iodophenyl)-1,2,3,4-tetrahydroisoquinolin-6-yl]oxy]ethanamine IUPAC Name: N,N-diethyl-2-[[1-(3-iodophenyl)-1,2,3,4-tetrahydroisoquinolin-6-yl]oxy]ethanamine Traditional Name: diethyl-[2-[[1-(3-iodophenyl)-1,2,3,4-tetrahydroisoquinolin-6-yl]oxy]ethyl]amine Formula: C21H27IN2O MolecularWeight: 450.35635

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC1=CC2=C(C=C1)C(NCC2)C3=CC(=CC=C3)I

Isomeric SMILES

CCN(CC)CCOC1=CC2=C(C=C1)C(NCC2)C3=CC(=CC=C3)I

InChI

InChI=1S/C21H27IN2O/c1-3-24(4-2)12-13-25-19-8-9-20-16(15-19)10-11-23-21(20)17-6-5-7-18(22)14-17/h5-9,14-15,21,23H,3-4,10-13H2,1-2H3