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

Systemtic Name: 1-tert-butyl-N-(furan-2-ylmethyl)-4-methyl-5-(3-methyl-4-nitro-phenoxy)pyrazole-3-carboxamide Openeye Name: 1-tert-butyl-N-(2-furylmethyl)-4-methyl-5-(3-methyl-4-nitro-phenoxy)pyrazole-3-carboxamide CAS Name: 1-tert-butyl-N-(2-furanylmethyl)-4-methyl-5-(3-methyl-4-nitrophenoxy)-3-pyrazolecarboxamide IUPAC Name: 1-tert-butyl-N-(furan-2-ylmethyl)-4-methyl-5-(3-methyl-4-nitrophenoxy)pyrazole-3-carboxamide Traditional Name: 1-tert-butyl-N-(2-furfuryl)-4-methyl-5-(3-methyl-4-nitro-phenoxy)pyrazole-3-carboxamide Formula: C21H24N4O5 MolecularWeight: 412.43906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=C(C(=NN2C(C)(C)C)C(=O)NCC3=CC=CO3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=C(C(=NN2C(C)(C)C)C(=O)NCC3=CC=CO3)C)[N+](=O)[O-]

InChI

InChI=1S/C21H24N4O5/c1-13-11-15(8-9-17(13)25(27)28)30-20-14(2)18(23-24(20)21(3,4)5)19(26)22-12-16-7-6-10-29-16/h6-11H,12H2,1-5H3,(H,22,26)