4-[[4-(4-chlorophenyl)piperazin-1-ium-1-yl]methyl]phenol

Systemtic Name: 4-[[4-(4-chlorophenyl)piperazin-1-ium-1-yl]methyl]phenol Openeye Name: 4-[[4-(4-chlorophenyl)piperazin-1-ium-1-yl]methyl]phenol CAS Name: 4-[[4-(4-chlorophenyl)-1-piperazin-1-iumyl]methyl]phenol IUPAC Name: 4-[[4-(4-chlorophenyl)piperazin-1-ium-1-yl]methyl]phenol Traditional Name: 4-[[4-(4-chlorophenyl)piperazin-1-ium-1-yl]methyl]phenol Formula: C17H20ClN2O+ MolecularWeight: 303.8065

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19ClN2O/c18-15-3-5-16(6-4-15)20-11-9-19(10-12-20)13-14-1-7-17(21)8-2-14/h1-8,21H,9-13H2/p+1