4-[4-(2-hydroxyethyl)piperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 4-[4-(2-hydroxyethyl)piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 4-[4-(2-hydroxyethyl)piperazin-1-yl]sulfonylbenzonitrile CAS Name: 4-[[4-(2-hydroxyethyl)-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 4-[4-(2-hydroxyethyl)piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 4-[4-(2-hydroxyethyl)piperazino]sulfonylbenzonitrile Formula: C13H17N3O3S MolecularWeight: 295.35738

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCO)S(=O)(=O)C2=CC=C(C=C2)C#N

Isomeric SMILES

C1CN(CCN1CCO)S(=O)(=O)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C13H17N3O3S/c14-11-12-1-3-13(4-2-12)20(18,19)16-7-5-15(6-8-16)9-10-17/h1-4,17H,5-10H2