(5-chloranyl-2-oxidanyl-phenyl)-(4-phenethylpiperazin-4-ium-1-yl)methanone

Systemtic Name: (5-chloranyl-2-oxidanyl-phenyl)-(4-phenethylpiperazin-4-ium-1-yl)methanone Openeye Name: (5-chloro-2-hydroxy-phenyl)-(4-phenethylpiperazin-4-ium-1-yl)methanone CAS Name: (5-chloro-2-hydroxyphenyl)-(4-phenethyl-1-piperazin-4-iumyl)methanone IUPAC Name: (5-chloro-2-hydroxyphenyl)-(4-phenethylpiperazin-4-ium-1-yl)methanone Traditional Name: (5-chloro-2-hydroxy-phenyl)-(4-phenethylpiperazin-4-ium-1-yl)methanone Formula: C19H22ClN2O2+ MolecularWeight: 345.84318

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCC2=CC=CC=C2)C(=O)C3=C(C=CC(=C3)Cl)O

Isomeric SMILES

C1CN(CC[NH+]1CCC2=CC=CC=C2)C(=O)C3=C(C=CC(=C3)Cl)O

InChI

InChI=1S/C19H21ClN2O2/c20-16-6-7-18(23)17(14-16)19(24)22-12-10-21(11-13-22)9-8-15-4-2-1-3-5-15/h1-7,14,23H,8-13H2/p+1