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

Systemtic Name: N-(2-chlorophenyl)-3-[1-[(1-phenylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]propanamide Openeye Name: N-(2-chlorophenyl)-3-[1-[(1-phenylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]propanamide CAS Name: N-(2-chlorophenyl)-3-[1-[(1-phenyl-4-pyrazolyl)methyl]-4-piperidin-1-iumyl]propanamide IUPAC Name: N-(2-chlorophenyl)-3-[1-[(1-phenylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]propanamide Traditional Name: N-(2-chlorophenyl)-3-[1-[(1-phenylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]propionamide Formula: C24H28ClN4O+ MolecularWeight: 423.95832

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1CCC(=O)NC2=CC=CC=C2Cl)CC3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1CCC(=O)NC2=CC=CC=C2Cl)CC3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H27ClN4O/c25-22-8-4-5-9-23(22)27-24(30)11-10-19-12-14-28(15-13-19)17-20-16-26-29(18-20)21-6-2-1-3-7-21/h1-9,16,18-19H,10-15,17H2,(H,27,30)/p+1