2-(4-bromanyl-5-methyl-3-nitro-pyrazol-1-yl)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone

Systemtic Name: 2-(4-bromanyl-5-methyl-3-nitro-pyrazol-1-yl)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone Openeye Name: 2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone CAS Name: 2-(4-bromo-5-methyl-3-nitro-1-pyrazolyl)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone IUPAC Name: 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone Traditional Name: 2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone Formula: C15H15BrN4O3 MolecularWeight: 379.2086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)N2CCC3=CC=CC=C3C2)[N+](=O)[O-])Br

Isomeric SMILES

CC1=C(C(=NN1CC(=O)N2CCC3=CC=CC=C3C2)[N+](=O)[O-])Br

InChI

InChI=1S/C15H15BrN4O3/c1-10-14(16)15(20(22)23)17-19(10)9-13(21)18-7-6-11-4-2-3-5-12(11)8-18/h2-5H,6-9H2,1H3