[2-(2,4-dimethylphenyl)-5-(4-nitrophenyl)pyrazol-3-yl]-morpholin-4-yl-methanone

Systemtic Name: [2-(2,4-dimethylphenyl)-5-(4-nitrophenyl)pyrazol-3-yl]-morpholin-4-yl-methanone Openeye Name: [2-(2,4-dimethylphenyl)-5-(4-nitrophenyl)pyrazol-3-yl]-morpholino-methanone CAS Name: [2-(2,4-dimethylphenyl)-5-(4-nitrophenyl)-3-pyrazolyl]-(4-morpholinyl)methanone IUPAC Name: [2-(2,4-dimethylphenyl)-5-(4-nitrophenyl)pyrazol-3-yl]-morpholin-4-ylmethanone Traditional Name: [2-(2,4-dimethylphenyl)-5-(4-nitrophenyl)pyrazol-3-yl]-morpholino-methanone Formula: C22H22N4O4 MolecularWeight: 406.43448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=CC(=N2)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)N4CCOCC4)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=CC(=N2)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)N4CCOCC4)C

InChI

InChI=1S/C22H22N4O4/c1-15-3-8-20(16(2)13-15)25-21(22(27)24-9-11-30-12-10-24)14-19(23-25)17-4-6-18(7-5-17)26(28)29/h3-8,13-14H,9-12H2,1-2H3