1-(3-chlorophenyl)-4-[(4-phenylmethoxyphenyl)methyl]piperazin-4-ium

Systemtic Name: 1-(3-chlorophenyl)-4-[(4-phenylmethoxyphenyl)methyl]piperazin-4-ium Openeye Name: 1-[(4-benzyloxyphenyl)methyl]-4-(3-chlorophenyl)piperazin-1-ium CAS Name: 1-(3-chlorophenyl)-4-[(4-phenylmethoxyphenyl)methyl]piperazin-4-ium IUPAC Name: 1-(3-chlorophenyl)-4-[(4-phenylmethoxyphenyl)methyl]piperazin-4-ium Traditional Name: 1-(4-benzoxybenzyl)-4-(3-chlorophenyl)piperazin-1-ium Formula: C24H26ClN2O+ MolecularWeight: 393.92904

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=C(C=C2)OCC3=CC=CC=C3)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=C(C=C2)OCC3=CC=CC=C3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C24H25ClN2O/c25-22-7-4-8-23(17-22)27-15-13-26(14-16-27)18-20-9-11-24(12-10-20)28-19-21-5-2-1-3-6-21/h1-12,17H,13-16,18-19H2/p+1