3,4-dihydro-1H-isoquinolin-2-yl-(4-iodanyl-2-methyl-pyrazol-3-yl)methanone

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-(4-iodanyl-2-methyl-pyrazol-3-yl)methanone Openeye Name: 3,4-dihydro-1H-isoquinolin-2-yl-(4-iodo-2-methyl-pyrazol-3-yl)methanone CAS Name: 3,4-dihydro-1H-isoquinolin-2-yl-(4-iodo-2-methyl-3-pyrazolyl)methanone IUPAC Name: 3,4-dihydro-1H-isoquinolin-2-yl-(4-iodo-2-methylpyrazol-3-yl)methanone Traditional Name: 3,4-dihydro-1H-isoquinolin-2-yl-(4-iodo-2-methyl-pyrazol-3-yl)methanone Formula: C14H14IN3O MolecularWeight: 367.18493

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)I)C(=O)N2CCC3=CC=CC=C3C2

Isomeric SMILES

CN1C(=C(C=N1)I)C(=O)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C14H14IN3O/c1-17-13(12(15)8-16-17)14(19)18-7-6-10-4-2-3-5-11(10)9-18/h2-5,8H,6-7,9H2,1H3