N-(2-fluorophenyl)-3-[(3R)-1-[(1-phenylpyrazol-4-yl)methyl]piperidin-1-ium-3-yl]propanamide

Systemtic Name: N-(2-fluorophenyl)-3-[(3R)-1-[(1-phenylpyrazol-4-yl)methyl]piperidin-1-ium-3-yl]propanamide Openeye Name: N-(2-fluorophenyl)-3-[(3R)-1-[(1-phenylpyrazol-4-yl)methyl]piperidin-1-ium-3-yl]propanamide CAS Name: N-(2-fluorophenyl)-3-[(3R)-1-[(1-phenyl-4-pyrazolyl)methyl]-3-piperidin-1-iumyl]propanamide IUPAC Name: N-(2-fluorophenyl)-3-[(3R)-1-[(1-phenylpyrazol-4-yl)methyl]piperidin-1-ium-3-yl]propanamide Traditional Name: N-(2-fluorophenyl)-3-[(3R)-1-[(1-phenylpyrazol-4-yl)methyl]piperidin-1-ium-3-yl]propionamide Formula: C24H28FN4O+ MolecularWeight: 407.503723

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=CN(N=C2)C3=CC=CC=C3)CCC(=O)NC4=CC=CC=C4F

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CC2=CN(N=C2)C3=CC=CC=C3)CCC(=O)NC4=CC=CC=C4F

InChI

InChI=1S/C24H27FN4O/c25-22-10-4-5-11-23(22)27-24(30)13-12-19-7-6-14-28(16-19)17-20-15-26-29(18-20)21-8-2-1-3-9-21/h1-5,8-11,15,18-19H,6-7,12-14,16-17H2,(H,27,30)/p+1/t19-/m1/s1