1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3-iodanylphenoxy)ethanone

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3-iodanylphenoxy)ethanone Openeye Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3-iodophenoxy)ethanone CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3-iodophenoxy)ethanone IUPAC Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3-iodophenoxy)ethanone Traditional Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3-iodophenoxy)ethanone Formula: C17H16INO2 MolecularWeight: 393.21891

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)COC3=CC(=CC=C3)I

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)COC3=CC(=CC=C3)I

InChI

InChI=1S/C17H16INO2/c18-15-6-3-7-16(10-15)21-12-17(20)19-9-8-13-4-1-2-5-14(13)11-19/h1-7,10H,8-9,11-12H2