4-[4-(2-pyrrolidin-1-ium-1-ylethoxy)phenyl]-1H-pyrazole

Systemtic Name: 4-[4-(2-pyrrolidin-1-ium-1-ylethoxy)phenyl]-1H-pyrazole Openeye Name: 4-[4-(2-pyrrolidin-1-ium-1-ylethoxy)phenyl]-1H-pyrazole CAS Name: 4-[4-[2-(1-pyrrolidin-1-iumyl)ethoxy]phenyl]-1H-pyrazole IUPAC Name: 4-[4-(2-pyrrolidin-1-ium-1-ylethoxy)phenyl]-1H-pyrazole Traditional Name: 4-[4-(2-pyrrolidin-1-ium-1-ylethoxy)phenyl]-1H-pyrazole Formula: C15H20N3O+ MolecularWeight: 258.3388

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCOC2=CC=C(C=C2)C3=CNN=C3

Isomeric SMILES

C1CC[NH+](C1)CCOC2=CC=C(C=C2)C3=CNN=C3

InChI

InChI=1S/C15H19N3O/c1-2-8-18(7-1)9-10-19-15-5-3-13(4-6-15)14-11-16-17-12-14/h3-6,11-12H,1-2,7-10H2,(H,16,17)/p+1