6-bromanyl-1-[[4-(3-chlorophenyl)piperazin-1-ium-1-yl]methyl]naphthalen-2-ol

Systemtic Name: 6-bromanyl-1-[[4-(3-chlorophenyl)piperazin-1-ium-1-yl]methyl]naphthalen-2-ol Openeye Name: 6-bromo-1-[[4-(3-chlorophenyl)piperazin-1-ium-1-yl]methyl]naphthalen-2-ol CAS Name: 6-bromo-1-[[4-(3-chlorophenyl)-1-piperazin-1-iumyl]methyl]-2-naphthalenol IUPAC Name: 6-bromo-1-[[4-(3-chlorophenyl)piperazin-1-ium-1-yl]methyl]naphthalen-2-ol Traditional Name: 6-bromo-1-[[4-(3-chlorophenyl)piperazin-1-ium-1-yl]methyl]-2-naphthol Formula: C21H21BrClN2O+ MolecularWeight: 432.76124

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=C(C=CC3=C2C=CC(=C3)Br)O)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1CN(CC[NH+]1CC2=C(C=CC3=C2C=CC(=C3)Br)O)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C21H20BrClN2O/c22-16-5-6-19-15(12-16)4-7-21(26)20(19)14-24-8-10-25(11-9-24)18-3-1-2-17(23)13-18/h1-7,12-13,26H,8-11,14H2/p+1