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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21N3O3/c1-12-16(13(2)18-17-12)6-4-3-5-11-22-15-9-7-14(8-10-15)19(20)21/h7-10H,3-6,11H2,1-2H3,(H,17,18)