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

Systemtic Name: 3,5-dimethyl-4-[5-(2-nitrophenoxy)pentyl]-1H-pyrazole Openeye Name: 3,5-dimethyl-4-[5-(2-nitrophenoxy)pentyl]-1H-pyrazole CAS Name: 3,5-dimethyl-4-[5-(2-nitrophenoxy)pentyl]-1H-pyrazole IUPAC Name: 3,5-dimethyl-4-[5-(2-nitrophenoxy)pentyl]-1H-pyrazole Traditional Name: 3,5-dimethyl-4-[5-(2-nitrophenoxy)pentyl]-1H-pyrazole Formula: C16H21N3O3 MolecularWeight: 303.35624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)CCCCCOC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1)C)CCCCCOC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C16H21N3O3/c1-12-14(13(2)18-17-12)8-4-3-7-11-22-16-10-6-5-9-15(16)19(20)21/h5-6,9-10H,3-4,7-8,11H2,1-2H3,(H,17,18)