4-morpholin-4-yl-3-nitro-N-(1,3,5-trimethylpyrazol-4-yl)benzamide

Systemtic Name: 4-morpholin-4-yl-3-nitro-N-(1,3,5-trimethylpyrazol-4-yl)benzamide Openeye Name: 4-morpholino-3-nitro-N-(1,3,5-trimethylpyrazol-4-yl)benzamide CAS Name: 4-(4-morpholinyl)-3-nitro-N-(1,3,5-trimethyl-4-pyrazolyl)benzamide IUPAC Name: 4-morpholin-4-yl-3-nitro-N-(1,3,5-trimethylpyrazol-4-yl)benzamide Traditional Name: 4-morpholino-3-nitro-N-(1,3,5-trimethylpyrazol-4-yl)benzamide Formula: C17H21N5O4 MolecularWeight: 359.37974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)NC(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C)C)NC(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C17H21N5O4/c1-11-16(12(2)20(3)19-11)18-17(23)13-4-5-14(15(10-13)22(24)25)21-6-8-26-9-7-21/h4-5,10H,6-9H2,1-3H3,(H,18,23)