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

Systemtic Name: (5-chloranyl-2-oxidanyl-phenyl)-piperazin-4-ium-1-yl-methanone Openeye Name: (5-chloro-2-hydroxy-phenyl)-piperazin-4-ium-1-yl-methanone CAS Name: (5-chloro-2-hydroxyphenyl)-(1-piperazin-4-iumyl)methanone IUPAC Name: (5-chloro-2-hydroxyphenyl)-piperazin-4-ium-1-ylmethanone Traditional Name: (5-chloro-2-hydroxy-phenyl)-piperazin-4-ium-1-yl-methanone Formula: C11H14ClN2O2+ MolecularWeight: 241.69406

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C(=O)C2=C(C=CC(=C2)Cl)O

Isomeric SMILES

C1CN(CC[NH2+]1)C(=O)C2=C(C=CC(=C2)Cl)O

InChI

InChI=1S/C11H13ClN2O2/c12-8-1-2-10(15)9(7-8)11(16)14-5-3-13-4-6-14/h1-2,7,13,15H,3-6H2/p+1