1-[[3-(4-chloranylphenoxy)phenyl]methyl]-4-(phenylmethyl)piperidin-1-ium

Systemtic Name: 1-[[3-(4-chloranylphenoxy)phenyl]methyl]-4-(phenylmethyl)piperidin-1-ium Openeye Name: 4-benzyl-1-[[3-(4-chlorophenoxy)phenyl]methyl]piperidin-1-ium CAS Name: 1-[[3-(4-chlorophenoxy)phenyl]methyl]-4-(phenylmethyl)piperidin-1-ium IUPAC Name: 4-benzyl-1-[[3-(4-chlorophenoxy)phenyl]methyl]piperidin-1-ium Traditional Name: 4-benzyl-1-[3-(4-chlorophenoxy)benzyl]piperidin-1-ium Formula: C25H27ClNO+ MolecularWeight: 392.94098

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1CC2=CC=CC=C2)CC3=CC(=CC=C3)OC4=CC=C(C=C4)Cl

Isomeric SMILES

C1C[NH+](CCC1CC2=CC=CC=C2)CC3=CC(=CC=C3)OC4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H26ClNO/c26-23-9-11-24(12-10-23)28-25-8-4-7-22(18-25)19-27-15-13-21(14-16-27)17-20-5-2-1-3-6-20/h1-12,18,21H,13-17,19H2/p+1