5-cyclopropyl-1-(2-methylphenyl)-N-[2-(4-nitrophenyl)-2-oxidanyl-ethyl]pyrazole-4-carboxamide

Systemtic Name: 5-cyclopropyl-1-(2-methylphenyl)-N-[2-(4-nitrophenyl)-2-oxidanyl-ethyl]pyrazole-4-carboxamide Openeye Name: 5-cyclopropyl-N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-1-(o-tolyl)pyrazole-4-carboxamide CAS Name: 5-cyclopropyl-N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-1-(2-methylphenyl)-4-pyrazolecarboxamide IUPAC Name: 5-cyclopropyl-N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-1-(2-methylphenyl)pyrazole-4-carboxamide Traditional Name: 5-cyclopropyl-N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-1-(o-tolyl)pyrazole-4-carboxamide Formula: C22H22N4O4 MolecularWeight: 406.43448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=C(C=N2)C(=O)NCC(C3=CC=C(C=C3)[N+](=O)[O-])O)C4CC4

Isomeric SMILES

CC1=CC=CC=C1N2C(=C(C=N2)C(=O)NCC(C3=CC=C(C=C3)[N+](=O)[O-])O)C4CC4

InChI

InChI=1S/C22H22N4O4/c1-14-4-2-3-5-19(14)25-21(16-6-7-16)18(12-24-25)22(28)23-13-20(27)15-8-10-17(11-9-15)26(29)30/h2-5,8-12,16,20,27H,6-7,13H2,1H3,(H,23,28)