3-[bis(fluoranyl)methyl]-5-phenyl-1-[4-(3-pyrrolidin-1-ylpropoxy)phenyl]pyrazole

Systemtic Name: 3-[bis(fluoranyl)methyl]-5-phenyl-1-[4-(3-pyrrolidin-1-ylpropoxy)phenyl]pyrazole Openeye Name: 3-(difluoromethyl)-5-phenyl-1-[4-(3-pyrrolidin-1-ylpropoxy)phenyl]pyrazole CAS Name: 3-(difluoromethyl)-5-phenyl-1-[4-[3-(1-pyrrolidinyl)propoxy]phenyl]pyrazole IUPAC Name: 3-(difluoromethyl)-5-phenyl-1-[4-(3-pyrrolidin-1-ylpropoxy)phenyl]pyrazole Traditional Name: 3-(difluoromethyl)-5-phenyl-1-[4-(3-pyrrolidinopropoxy)phenyl]pyrazole Formula: C23H25F2N3O MolecularWeight: 397.460906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCCOC2=CC=C(C=C2)N3C(=CC(=N3)C(F)F)C4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)CCCOC2=CC=C(C=C2)N3C(=CC(=N3)C(F)F)C4=CC=CC=C4

InChI

InChI=1S/C23H25F2N3O/c24-23(25)21-17-22(18-7-2-1-3-8-18)28(26-21)19-9-11-20(12-10-19)29-16-6-15-27-13-4-5-14-27/h1-3,7-12,17,23H,4-6,13-16H2