4-piperazin-1-ylcarbonylbenzenecarbonitrile hydrochloride

Systemtic Name: 4-piperazin-1-ylcarbonylbenzenecarbonitrile hydrochloride Openeye Name: 4-(piperazine-1-carbonyl)benzonitrile hydrochloride CAS Name: 4-[oxo(1-piperazinyl)methyl]benzonitrile hydrochloride IUPAC Name: 4-(piperazine-1-carbonyl)benzonitrile hydrochloride Traditional Name: 4-(piperazine-1-carbonyl)benzonitrile hydrochloride Formula: C12H14ClN3O MolecularWeight: 251.71206

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C(=O)C2=CC=C(C=C2)C#N.Cl

Isomeric SMILES

C1CN(CCN1)C(=O)C2=CC=C(C=C2)C#N.Cl

InChI

InChI=1S/C12H13N3O.ClH/c13-9-10-1-3-11(4-2-10)12(16)15-7-5-14-6-8-15;/h1-4,14H,5-8H2;1H