[3-(4-methoxy-3-nitro-phenyl)-1-phenyl-pyrazol-4-yl]-morpholin-4-yl-methanone

Systemtic Name: [3-(4-methoxy-3-nitro-phenyl)-1-phenyl-pyrazol-4-yl]-morpholin-4-yl-methanone Openeye Name: [3-(4-methoxy-3-nitro-phenyl)-1-phenyl-pyrazol-4-yl]-morpholino-methanone CAS Name: [3-(4-methoxy-3-nitrophenyl)-1-phenyl-4-pyrazolyl]-(4-morpholinyl)methanone IUPAC Name: [3-(4-methoxy-3-nitrophenyl)-1-phenylpyrazol-4-yl]-morpholin-4-ylmethanone Traditional Name: [3-(4-methoxy-3-nitro-phenyl)-1-phenyl-pyrazol-4-yl]-morpholino-methanone Formula: C21H20N4O5 MolecularWeight: 408.4073

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C=C2C(=O)N3CCOCC3)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C=C2C(=O)N3CCOCC3)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H20N4O5/c1-29-19-8-7-15(13-18(19)25(27)28)20-17(21(26)23-9-11-30-12-10-23)14-24(22-20)16-5-3-2-4-6-16/h2-8,13-14H,9-12H2,1H3