1-tert-butyl-N-cyclopropyl-4-methyl-5-(2-nitrophenoxy)pyrazole-3-carboxamide

Systemtic Name: 1-tert-butyl-N-cyclopropyl-4-methyl-5-(2-nitrophenoxy)pyrazole-3-carboxamide Openeye Name: 1-tert-butyl-N-cyclopropyl-4-methyl-5-(2-nitrophenoxy)pyrazole-3-carboxamide CAS Name: 1-tert-butyl-N-cyclopropyl-4-methyl-5-(2-nitrophenoxy)-3-pyrazolecarboxamide IUPAC Name: 1-tert-butyl-N-cyclopropyl-4-methyl-5-(2-nitrophenoxy)pyrazole-3-carboxamide Traditional Name: 1-tert-butyl-N-cyclopropyl-4-methyl-5-(2-nitrophenoxy)pyrazole-3-carboxamide Formula: C18H22N4O4 MolecularWeight: 358.39168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(N=C1C(=O)NC2CC2)C(C)(C)C)OC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=C(N(N=C1C(=O)NC2CC2)C(C)(C)C)OC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C18H22N4O4/c1-11-15(16(23)19-12-9-10-12)20-21(18(2,3)4)17(11)26-14-8-6-5-7-13(14)22(24)25/h5-8,12H,9-10H2,1-4H3,(H,19,23)