4-[3-(3,5-dimethylpyrazol-1-yl)azetidin-1-ium-1-yl]-1-[4-(furan-2-yl)phenyl]piperidine

Systemtic Name: 4-[3-(3,5-dimethylpyrazol-1-yl)azetidin-1-ium-1-yl]-1-[4-(furan-2-yl)phenyl]piperidine Openeye Name: 4-[3-(3,5-dimethylpyrazol-1-yl)azetidin-1-ium-1-yl]-1-[4-(2-furyl)phenyl]piperidine CAS Name: 4-[3-(3,5-dimethyl-1-pyrazolyl)-1-azetidin-1-iumyl]-1-[4-(2-furanyl)phenyl]piperidine IUPAC Name: 4-[3-(3,5-dimethylpyrazol-1-yl)azetidin-1-ium-1-yl]-1-[4-(furan-2-yl)phenyl]piperidine Traditional Name: 4-[3-(3,5-dimethylpyrazol-1-yl)azetidin-1-ium-1-yl]-1-[4-(2-furyl)phenyl]piperidine Formula: C23H29N4O+ MolecularWeight: 377.50256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2C[NH+](C2)C3CCN(CC3)C4=CC=C(C=C4)C5=CC=CO5)C

Isomeric SMILES

CC1=CC(=NN1C2C[NH+](C2)C3CCN(CC3)C4=CC=C(C=C4)C5=CC=CO5)C

InChI

InChI=1S/C23H28N4O/c1-17-14-18(2)27(24-17)22-15-26(16-22)21-9-11-25(12-10-21)20-7-5-19(6-8-20)23-4-3-13-28-23/h3-8,13-14,21-22H,9-12,15-16H2,1-2H3/p+1