1-(3,4-dihydro-2H-quinolin-1-yl)-2-(4-iodanyl-3,5-dimethyl-pyrazol-1-yl)ethanone

Systemtic Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-(4-iodanyl-3,5-dimethyl-pyrazol-1-yl)ethanone Openeye Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-(4-iodo-3,5-dimethyl-pyrazol-1-yl)ethanone CAS Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-(4-iodo-3,5-dimethyl-1-pyrazolyl)ethanone IUPAC Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-(4-iodo-3,5-dimethylpyrazol-1-yl)ethanone Traditional Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-(4-iodo-3,5-dimethyl-pyrazol-1-yl)ethanone Formula: C16H18IN3O MolecularWeight: 395.23809

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)N2CCCC3=CC=CC=C32)C)I

Isomeric SMILES

CC1=C(C(=NN1CC(=O)N2CCCC3=CC=CC=C32)C)I

InChI

InChI=1S/C16H18IN3O/c1-11-16(17)12(2)20(18-11)10-15(21)19-9-5-7-13-6-3-4-8-14(13)19/h3-4,6,8H,5,7,9-10H2,1-2H3