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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18N4O4/c1-3-11(2)16-15(20)12-8-9-18(17-12)10-23-14-7-5-4-6-13(14)19(21)22/h4-9,11H,3,10H2,1-2H3,(H,16,20)