(3R)-1-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-N-[4-(furan-2-yl)phenyl]piperidin-1-ium-3-carboxamide

Systemtic Name: (3R)-1-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-N-[4-(furan-2-yl)phenyl]piperidin-1-ium-3-carboxamide Openeye Name: (3R)-1-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-N-[4-(2-furyl)phenyl]piperidin-1-ium-3-carboxamide CAS Name: (3R)-1-[(1-ethyl-3-methyl-4-pyrazolyl)methyl]-N-[4-(2-furanyl)phenyl]-3-piperidin-1-iumcarboxamide IUPAC Name: (3R)-1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-N-[4-(furan-2-yl)phenyl]piperidin-1-ium-3-carboxamide Traditional Name: (3R)-1-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-N-[4-(2-furyl)phenyl]piperidin-1-ium-3-carboxamide Formula: C23H29N4O2+ MolecularWeight: 393.50196

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C)C[NH+]2CCCC(C2)C(=O)NC3=CC=C(C=C3)C4=CC=CO4

Isomeric SMILES

CCN1C=C(C(=N1)C)C[NH+]2CCC[C@H](C2)C(=O)NC3=CC=C(C=C3)C4=CC=CO4

InChI

InChI=1S/C23H28N4O2/c1-3-27-16-20(17(2)25-27)15-26-12-4-6-19(14-26)23(28)24-21-10-8-18(9-11-21)22-7-5-13-29-22/h5,7-11,13,16,19H,3-4,6,12,14-15H2,1-2H3,(H,24,28)/p+1/t19-/m1/s1