2,4-bis(chloranyl)-6-[(4-phenylpiperazin-1-ium-1-yl)methyl]phenol

Systemtic Name: 2,4-bis(chloranyl)-6-[(4-phenylpiperazin-1-ium-1-yl)methyl]phenol Openeye Name: 2,4-dichloro-6-[(4-phenylpiperazin-1-ium-1-yl)methyl]phenol CAS Name: 2,4-dichloro-6-[(4-phenyl-1-piperazin-1-iumyl)methyl]phenol IUPAC Name: 2,4-dichloro-6-[(4-phenylpiperazin-1-ium-1-yl)methyl]phenol Traditional Name: 2,4-dichloro-6-[(4-phenylpiperazin-1-ium-1-yl)methyl]phenol Formula: C17H19Cl2N2O+ MolecularWeight: 338.25156

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC(=CC(=C2O)Cl)Cl)C3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC(=CC(=C2O)Cl)Cl)C3=CC=CC=C3

InChI

InChI=1S/C17H18Cl2N2O/c18-14-10-13(17(22)16(19)11-14)12-20-6-8-21(9-7-20)15-4-2-1-3-5-15/h1-5,10-11,22H,6-9,12H2/p+1