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

Systemtic Name: 1-tert-butyl-N-(furan-2-ylmethyl)-4-methyl-5-(2-nitrophenoxy)pyrazole-3-carboxamide Openeye Name: 1-tert-butyl-N-(2-furylmethyl)-4-methyl-5-(2-nitrophenoxy)pyrazole-3-carboxamide CAS Name: 1-tert-butyl-N-(2-furanylmethyl)-4-methyl-5-(2-nitrophenoxy)-3-pyrazolecarboxamide IUPAC Name: 1-tert-butyl-N-(furan-2-ylmethyl)-4-methyl-5-(2-nitrophenoxy)pyrazole-3-carboxamide Traditional Name: 1-tert-butyl-N-(2-furfuryl)-4-methyl-5-(2-nitrophenoxy)pyrazole-3-carboxamide Formula: C20H22N4O5 MolecularWeight: 398.41248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(N=C1C(=O)NCC2=CC=CO2)C(C)(C)C)OC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=C(N(N=C1C(=O)NCC2=CC=CO2)C(C)(C)C)OC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O5/c1-13-17(18(25)21-12-14-8-7-11-28-14)22-23(20(2,3)4)19(13)29-16-10-6-5-9-15(16)24(26)27/h5-11H,12H2,1-4H3,(H,21,25)