3,5-dimethyl-4-[4-(2-nitrophenoxy)butyl]-1H-pyrazole

Systemtic Name: 3,5-dimethyl-4-[4-(2-nitrophenoxy)butyl]-1H-pyrazole Openeye Name: 3,5-dimethyl-4-[4-(2-nitrophenoxy)butyl]-1H-pyrazole CAS Name: 3,5-dimethyl-4-[4-(2-nitrophenoxy)butyl]-1H-pyrazole IUPAC Name: 3,5-dimethyl-4-[4-(2-nitrophenoxy)butyl]-1H-pyrazole Traditional Name: 3,5-dimethyl-4-[4-(2-nitrophenoxy)butyl]-1H-pyrazole Formula: C15H19N3O3 MolecularWeight: 289.32966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)CCCCOC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1)C)CCCCOC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C15H19N3O3/c1-11-13(12(2)17-16-11)7-5-6-10-21-15-9-4-3-8-14(15)18(19)20/h3-4,8-9H,5-7,10H2,1-2H3,(H,16,17)