2-[4-(4-chloranyl-2-oxidanyl-phenyl)carbonylpiperazin-1-yl]pyridine-3-carbonitrile

Systemtic Name: 2-[4-(4-chloranyl-2-oxidanyl-phenyl)carbonylpiperazin-1-yl]pyridine-3-carbonitrile Openeye Name: 2-[4-(4-chloro-2-hydroxy-benzoyl)piperazin-1-yl]pyridine-3-carbonitrile CAS Name: 2-[4-[(4-chloro-2-hydroxyphenyl)-oxomethyl]-1-piperazinyl]-3-pyridinecarbonitrile IUPAC Name: 2-[4-(4-chloro-2-hydroxybenzoyl)piperazin-1-yl]pyridine-3-carbonitrile Traditional Name: 2-[4-(4-chloro-2-hydroxy-benzoyl)piperazino]nicotinonitrile Formula: C17H15ClN4O2 MolecularWeight: 342.7796

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=CC=N2)C#N)C(=O)C3=C(C=C(C=C3)Cl)O

Isomeric SMILES

C1CN(CCN1C2=C(C=CC=N2)C#N)C(=O)C3=C(C=C(C=C3)Cl)O

InChI

InChI=1S/C17H15ClN4O2/c18-13-3-4-14(15(23)10-13)17(24)22-8-6-21(7-9-22)16-12(11-19)2-1-5-20-16/h1-5,10,23H,6-9H2