3,4-dihydro-1H-isoquinolin-2-yl-[5-(furan-2-yl)-2-(4-nitrophenyl)pyrazol-3-yl]methanone

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-[5-(furan-2-yl)-2-(4-nitrophenyl)pyrazol-3-yl]methanone Openeye Name: 3,4-dihydro-1H-isoquinolin-2-yl-[5-(2-furyl)-2-(4-nitrophenyl)pyrazol-3-yl]methanone CAS Name: 3,4-dihydro-1H-isoquinolin-2-yl-[5-(2-furanyl)-2-(4-nitrophenyl)-3-pyrazolyl]methanone IUPAC Name: 3,4-dihydro-1H-isoquinolin-2-yl-[5-(furan-2-yl)-2-(4-nitrophenyl)pyrazol-3-yl]methanone Traditional Name: 3,4-dihydro-1H-isoquinolin-2-yl-[5-(2-furyl)-2-(4-nitrophenyl)pyrazol-3-yl]methanone Formula: C23H18N4O4 MolecularWeight: 414.41342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)C3=CC(=NN3C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CO5

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)C3=CC(=NN3C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CO5

InChI

InChI=1S/C23H18N4O4/c28-23(25-12-11-16-4-1-2-5-17(16)15-25)21-14-20(22-6-3-13-31-22)24-26(21)18-7-9-19(10-8-18)27(29)30/h1-10,13-14H,11-12,15H2