1-[3-(4-chloranylphenoxy)propyl]-4-(phenylmethyl)piperazin-1-ium

Systemtic Name: 1-[3-(4-chloranylphenoxy)propyl]-4-(phenylmethyl)piperazin-1-ium Openeye Name: 1-benzyl-4-[3-(4-chlorophenoxy)propyl]piperazin-4-ium CAS Name: 1-[3-(4-chlorophenoxy)propyl]-4-(phenylmethyl)piperazin-1-ium IUPAC Name: 1-benzyl-4-[3-(4-chlorophenoxy)propyl]piperazin-4-ium Traditional Name: 1-benzyl-4-[3-(4-chlorophenoxy)propyl]piperazin-4-ium Formula: C20H26ClN2O+ MolecularWeight: 345.88624

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCCOC2=CC=C(C=C2)Cl)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CCCOC2=CC=C(C=C2)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C20H25ClN2O/c21-19-7-9-20(10-8-19)24-16-4-11-22-12-14-23(15-13-22)17-18-5-2-1-3-6-18/h1-3,5-10H,4,11-17H2/p+1