1-[2-(azidomethyl)-4-methoxy-phenyl]-5-(furan-2-yl)-3-(trifluoromethyl)pyrazole

Systemtic Name: 1-[2-(azidomethyl)-4-methoxy-phenyl]-5-(furan-2-yl)-3-(trifluoromethyl)pyrazole Openeye Name: 1-[2-(azidomethyl)-4-methoxy-phenyl]-5-(2-furyl)-3-(trifluoromethyl)pyrazole CAS Name: 1-[2-(azidomethyl)-4-methoxyphenyl]-5-(2-furanyl)-3-(trifluoromethyl)pyrazole IUPAC Name: 1-[2-(azidomethyl)-4-methoxyphenyl]-5-(furan-2-yl)-3-(trifluoromethyl)pyrazole Traditional Name: 1-[2-(azidomethyl)-4-methoxy-phenyl]-5-(2-furyl)-3-(trifluoromethyl)pyrazole Formula: C16H12F3N5O2 MolecularWeight: 363.29399

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)N2C(=CC(=N2)C(F)(F)F)C3=CC=CO3)CN=[N+]=[N-]

Isomeric SMILES

COC1=CC(=C(C=C1)N2C(=CC(=N2)C(F)(F)F)C3=CC=CO3)CN=[N+]=[N-]

InChI

InChI=1S/C16H12F3N5O2/c1-25-11-4-5-12(10(7-11)9-21-23-20)24-13(14-3-2-6-26-14)8-15(22-24)16(17,18)19/h2-8H,9H2,1H3