2-(dimethylamino)-5-nitro-N-[1-(oxolan-2-ylmethyl)pyrazol-4-yl]benzamide

Systemtic Name: 2-(dimethylamino)-5-nitro-N-[1-(oxolan-2-ylmethyl)pyrazol-4-yl]benzamide Openeye Name: 2-(dimethylamino)-5-nitro-N-[1-(tetrahydrofuran-2-ylmethyl)pyrazol-4-yl]benzamide CAS Name: 2-(dimethylamino)-5-nitro-N-[1-(2-oxolanylmethyl)-4-pyrazolyl]benzamide IUPAC Name: 2-(dimethylamino)-5-nitro-N-[1-(oxolan-2-ylmethyl)pyrazol-4-yl]benzamide Traditional Name: 2-(dimethylamino)-5-nitro-N-[1-(tetrahydrofurfuryl)pyrazol-4-yl]benzamide Formula: C17H21N5O4 MolecularWeight: 359.37974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)NC2=CN(N=C2)CC3CCCO3

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)NC2=CN(N=C2)CC3CCCO3

InChI

InChI=1S/C17H21N5O4/c1-20(2)16-6-5-13(22(24)25)8-15(16)17(23)19-12-9-18-21(10-12)11-14-4-3-7-26-14/h5-6,8-10,14H,3-4,7,11H2,1-2H3,(H,19,23)