1-[(2-chloranyl-4-nitro-phenoxy)methyl]-N-(1-ethyl-5-morpholin-4-ylcarbonyl-pyrazol-4-yl)pyrazole-3-carboxamide

Systemtic Name: 1-[(2-chloranyl-4-nitro-phenoxy)methyl]-N-(1-ethyl-5-morpholin-4-ylcarbonyl-pyrazol-4-yl)pyrazole-3-carboxamide Openeye Name: 1-[(2-chloro-4-nitro-phenoxy)methyl]-N-[1-ethyl-5-(morpholine-4-carbonyl)pyrazol-4-yl]pyrazole-3-carboxamide CAS Name: 1-[(2-chloro-4-nitrophenoxy)methyl]-N-[1-ethyl-5-[4-morpholinyl(oxo)methyl]-4-pyrazolyl]-3-pyrazolecarboxamide IUPAC Name: 1-[(2-chloro-4-nitrophenoxy)methyl]-N-[1-ethyl-5-(morpholine-4-carbonyl)pyrazol-4-yl]pyrazole-3-carboxamide Traditional Name: 1-[(2-chloro-4-nitro-phenoxy)methyl]-N-[1-ethyl-5-(morpholine-4-carbonyl)pyrazol-4-yl]pyrazole-3-carboxamide Formula: C21H22ClN7O6 MolecularWeight: 503.89568

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)NC(=O)C2=NN(C=C2)COC3=C(C=C(C=C3)[N+](=O)[O-])Cl)C(=O)N4CCOCC4

Isomeric SMILES

CCN1C(=C(C=N1)NC(=O)C2=NN(C=C2)COC3=C(C=C(C=C3)[N+](=O)[O-])Cl)C(=O)N4CCOCC4

InChI

InChI=1S/C21H22ClN7O6/c1-2-28-19(21(31)26-7-9-34-10-8-26)17(12-23-28)24-20(30)16-5-6-27(25-16)13-35-18-4-3-14(29(32)33)11-15(18)22/h3-6,11-12H,2,7-10,13H2,1H3,(H,24,30)