N-(4-morpholin-4-ylcarbonyl-2-phenyl-pyrazol-3-yl)-4-nitro-benzamide

Systemtic Name: N-(4-morpholin-4-ylcarbonyl-2-phenyl-pyrazol-3-yl)-4-nitro-benzamide Openeye Name: N-[4-(morpholine-4-carbonyl)-2-phenyl-pyrazol-3-yl]-4-nitro-benzamide CAS Name: N-[4-[4-morpholinyl(oxo)methyl]-2-phenyl-3-pyrazolyl]-4-nitrobenzamide IUPAC Name: N-[4-(morpholine-4-carbonyl)-2-phenylpyrazol-3-yl]-4-nitrobenzamide Traditional Name: N-[4-(morpholine-4-carbonyl)-2-phenyl-pyrazol-3-yl]-4-nitro-benzamide Formula: C21H19N5O5 MolecularWeight: 421.40606

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)C2=C(N(N=C2)C3=CC=CC=C3)NC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C(=O)C2=C(N(N=C2)C3=CC=CC=C3)NC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H19N5O5/c27-20(15-6-8-17(9-7-15)26(29)30)23-19-18(21(28)24-10-12-31-13-11-24)14-22-25(19)16-4-2-1-3-5-16/h1-9,14H,10-13H2,(H,23,27)