3,4-dihydro-1H-isoquinolin-2-yl-(2,5-dimethyl-4-nitro-pyrazol-3-yl)methanone

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-(2,5-dimethyl-4-nitro-pyrazol-3-yl)methanone Openeye Name: 3,4-dihydro-1H-isoquinolin-2-yl-(2,5-dimethyl-4-nitro-pyrazol-3-yl)methanone CAS Name: 3,4-dihydro-1H-isoquinolin-2-yl-(2,5-dimethyl-4-nitro-3-pyrazolyl)methanone IUPAC Name: 3,4-dihydro-1H-isoquinolin-2-yl-(2,5-dimethyl-4-nitropyrazol-3-yl)methanone Traditional Name: 3,4-dihydro-1H-isoquinolin-2-yl-(2,5-dimethyl-4-nitro-pyrazol-3-yl)methanone Formula: C15H16N4O3 MolecularWeight: 300.31254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1[N+](=O)[O-])C(=O)N2CCC3=CC=CC=C3C2)C

Isomeric SMILES

CC1=NN(C(=C1[N+](=O)[O-])C(=O)N2CCC3=CC=CC=C3C2)C

InChI

InChI=1S/C15H16N4O3/c1-10-13(19(21)22)14(17(2)16-10)15(20)18-8-7-11-5-3-4-6-12(11)9-18/h3-6H,7-9H2,1-2H3