5-ethyl-1-(4-nitrophenyl)-3-[2-(oxan-2-yloxy)propan-2-yl]pyrazole

Systemtic Name: 5-ethyl-1-(4-nitrophenyl)-3-[2-(oxan-2-yloxy)propan-2-yl]pyrazole Openeye Name: 5-ethyl-3-(1-methyl-1-tetrahydropyran-2-yloxy-ethyl)-1-(4-nitrophenyl)pyrazole CAS Name: 5-ethyl-1-(4-nitrophenyl)-3-[2-(2-oxanyloxy)propan-2-yl]pyrazole IUPAC Name: 5-ethyl-1-(4-nitrophenyl)-3-[2-(oxan-2-yloxy)propan-2-yl]pyrazole Traditional Name: 5-ethyl-3-(1-methyl-1-tetrahydropyran-2-yloxy-ethyl)-1-(4-nitrophenyl)pyrazole Formula: C19H25N3O4 MolecularWeight: 359.4195

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=NN1C2=CC=C(C=C2)[N+](=O)[O-])C(C)(C)OC3CCCCO3

Isomeric SMILES

CCC1=CC(=NN1C2=CC=C(C=C2)[N+](=O)[O-])C(C)(C)OC3CCCCO3

InChI

InChI=1S/C19H25N3O4/c1-4-14-13-17(19(2,3)26-18-7-5-6-12-25-18)20-21(14)15-8-10-16(11-9-15)22(23)24/h8-11,13,18H,4-7,12H2,1-3H3