N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-4-phenoxy-butanamide

Systemtic Name: N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-4-phenoxy-butanamide Openeye Name: N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-4-phenoxy-butanamide CAS Name: N-[1-[(4-chlorophenyl)methyl]-4-piperidin-1-iumyl]-4-phenoxybutanamide IUPAC Name: N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-4-phenoxybutanamide Traditional Name: N-[1-(4-chlorobenzyl)piperidin-1-ium-4-yl]-4-phenoxy-butyramide Formula: C22H28ClN2O2+ MolecularWeight: 387.92292

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)CCCOC2=CC=CC=C2)CC3=CC=C(C=C3)Cl

Isomeric SMILES

C1C[NH+](CCC1NC(=O)CCCOC2=CC=CC=C2)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H27ClN2O2/c23-19-10-8-18(9-11-19)17-25-14-12-20(13-15-25)24-22(26)7-4-16-27-21-5-2-1-3-6-21/h1-3,5-6,8-11,20H,4,7,12-17H2,(H,24,26)/p+1