(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl-[1-[3-(furan-2-yl)phenyl]piperidin-4-yl]azanium

Systemtic Name: (1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl-[1-[3-(furan-2-yl)phenyl]piperidin-4-yl]azanium Openeye Name: (1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl-[1-[3-(2-furyl)phenyl]-4-piperidyl]ammonium CAS Name: (1-ethyl-3,5-dimethyl-4-pyrazolyl)methyl-[1-[3-(2-furanyl)phenyl]-4-piperidinyl]ammonium IUPAC Name: (1-ethyl-3,5-dimethylpyrazol-4-yl)methyl-[1-[3-(furan-2-yl)phenyl]piperidin-4-yl]azanium Traditional Name: (1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl-[1-[3-(2-furyl)phenyl]-4-piperidyl]ammonium Formula: C23H31N4O+ MolecularWeight: 379.51844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C)C[NH2+]C2CCN(CC2)C3=CC=CC(=C3)C4=CC=CO4)C

Isomeric SMILES

CCN1C(=C(C(=N1)C)C[NH2+]C2CCN(CC2)C3=CC=CC(=C3)C4=CC=CO4)C

InChI

InChI=1S/C23H30N4O/c1-4-27-18(3)22(17(2)25-27)16-24-20-10-12-26(13-11-20)21-8-5-7-19(15-21)23-9-6-14-28-23/h5-9,14-15,20,24H,4,10-13,16H2,1-3H3/p+1