N-(2-methyl-2-morpholin-4-yl-butyl)-1-(3-nitrophenyl)pyrazole-3-carboxamide

Systemtic Name: N-(2-methyl-2-morpholin-4-yl-butyl)-1-(3-nitrophenyl)pyrazole-3-carboxamide Openeye Name: N-(2-methyl-2-morpholino-butyl)-1-(3-nitrophenyl)pyrazole-3-carboxamide CAS Name: N-[2-methyl-2-(4-morpholinyl)butyl]-1-(3-nitrophenyl)-3-pyrazolecarboxamide IUPAC Name: N-(2-methyl-2-morpholin-4-ylbutyl)-1-(3-nitrophenyl)pyrazole-3-carboxamide Traditional Name: N-(2-methyl-2-morpholino-butyl)-1-(3-nitrophenyl)pyrazole-3-carboxamide Formula: C19H25N5O4 MolecularWeight: 387.4329

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(CNC(=O)C1=NN(C=C1)C2=CC(=CC=C2)[N+](=O)[O-])N3CCOCC3

Isomeric SMILES

CCC(C)(CNC(=O)C1=NN(C=C1)C2=CC(=CC=C2)[N+](=O)[O-])N3CCOCC3

InChI

InChI=1S/C19H25N5O4/c1-3-19(2,22-9-11-28-12-10-22)14-20-18(25)17-7-8-23(21-17)15-5-4-6-16(13-15)24(26)27/h4-8,13H,3,9-12,14H2,1-2H3,(H,20,25)