2-[4-(5-chloranyl-2-oxidanyl-phenyl)carbonylpiperazin-1-yl]pyridine-4-carbonitrile

Systemtic Name: 2-[4-(5-chloranyl-2-oxidanyl-phenyl)carbonylpiperazin-1-yl]pyridine-4-carbonitrile Openeye Name: 2-[4-(5-chloro-2-hydroxy-benzoyl)piperazin-1-yl]pyridine-4-carbonitrile CAS Name: 2-[4-[(5-chloro-2-hydroxyphenyl)-oxomethyl]-1-piperazinyl]-4-pyridinecarbonitrile IUPAC Name: 2-[4-(5-chloro-2-hydroxybenzoyl)piperazin-1-yl]pyridine-4-carbonitrile Traditional Name: 2-[4-(5-chloro-2-hydroxy-benzoyl)piperazino]isonicotinonitrile Formula: C17H15ClN4O2 MolecularWeight: 342.7796

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC(=C2)C#N)C(=O)C3=C(C=CC(=C3)Cl)O

Isomeric SMILES

C1CN(CCN1C2=NC=CC(=C2)C#N)C(=O)C3=C(C=CC(=C3)Cl)O

InChI

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