N-(2-methylpropyl)-1-[(2-nitrophenoxy)methyl]pyrazole-3-carboxamide

Systemtic Name: N-(2-methylpropyl)-1-[(2-nitrophenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-isobutyl-1-[(2-nitrophenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-(2-methylpropyl)-1-[(2-nitrophenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-(2-methylpropyl)-1-[(2-nitrophenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-isobutyl-1-[(2-nitrophenoxy)methyl]pyrazole-3-carboxamide Formula: C15H18N4O4 MolecularWeight: 318.32782

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=NN(C=C1)COC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC(C)CNC(=O)C1=NN(C=C1)COC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C15H18N4O4/c1-11(2)9-16-15(20)12-7-8-18(17-12)10-23-14-6-4-3-5-13(14)19(21)22/h3-8,11H,9-10H2,1-2H3,(H,16,20)