5-methyl-3-(2-methylpropyl)-1-(4-nitrophenyl)-N-(oxolan-2-ylmethyl)pyrazole-4-carboxamide

Systemtic Name: 5-methyl-3-(2-methylpropyl)-1-(4-nitrophenyl)-N-(oxolan-2-ylmethyl)pyrazole-4-carboxamide Openeye Name: 3-isobutyl-5-methyl-1-(4-nitrophenyl)-N-(tetrahydrofuran-2-ylmethyl)pyrazole-4-carboxamide CAS Name: 5-methyl-3-(2-methylpropyl)-1-(4-nitrophenyl)-N-(2-oxolanylmethyl)-4-pyrazolecarboxamide IUPAC Name: 5-methyl-3-(2-methylpropyl)-1-(4-nitrophenyl)-N-(oxolan-2-ylmethyl)pyrazole-4-carboxamide Traditional Name: 3-isobutyl-5-methyl-1-(4-nitrophenyl)-N-(tetrahydrofurfuryl)pyrazole-4-carboxamide Formula: C20H26N4O4 MolecularWeight: 386.44484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=C(C=C2)[N+](=O)[O-])CC(C)C)C(=O)NCC3CCCO3

Isomeric SMILES

CC1=C(C(=NN1C2=CC=C(C=C2)[N+](=O)[O-])CC(C)C)C(=O)NCC3CCCO3

InChI

InChI=1S/C20H26N4O4/c1-13(2)11-18-19(20(25)21-12-17-5-4-10-28-17)14(3)23(22-18)15-6-8-16(9-7-15)24(26)27/h6-9,13,17H,4-5,10-12H2,1-3H3,(H,21,25)