4-chloranyl-2-[[4-(2,5-dimethylphenyl)piperazin-1-ium-1-yl]methyl]phenol

Systemtic Name: 4-chloranyl-2-[[4-(2,5-dimethylphenyl)piperazin-1-ium-1-yl]methyl]phenol Openeye Name: 4-chloro-2-[[4-(2,5-dimethylphenyl)piperazin-1-ium-1-yl]methyl]phenol CAS Name: 4-chloro-2-[[4-(2,5-dimethylphenyl)-1-piperazin-1-iumyl]methyl]phenol IUPAC Name: 4-chloro-2-[[4-(2,5-dimethylphenyl)piperazin-1-ium-1-yl]methyl]phenol Traditional Name: 4-chloro-2-[[4-(2,5-dimethylphenyl)piperazin-1-ium-1-yl]methyl]phenol Formula: C19H24ClN2O+ MolecularWeight: 331.85966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CC[NH+](CC2)CC3=C(C=CC(=C3)Cl)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CC[NH+](CC2)CC3=C(C=CC(=C3)Cl)O

InChI

InChI=1S/C19H23ClN2O/c1-14-3-4-15(2)18(11-14)22-9-7-21(8-10-22)13-16-12-17(20)5-6-19(16)23/h3-6,11-12,23H,7-10,13H2,1-2H3/p+1