2-[4-(3-hydroxyphenyl)piperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-(3-hydroxyphenyl)piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-(3-hydroxyphenyl)piperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-(3-hydroxyphenyl)-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-(3-hydroxyphenyl)piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-(3-hydroxyphenyl)piperazino]sulfonylbenzonitrile Formula: C17H17N3O3S MolecularWeight: 343.40018

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)O)S(=O)(=O)C3=CC=CC=C3C#N

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)O)S(=O)(=O)C3=CC=CC=C3C#N

InChI

InChI=1S/C17H17N3O3S/c18-13-14-4-1-2-7-17(14)24(22,23)20-10-8-19(9-11-20)15-5-3-6-16(21)12-15/h1-7,12,21H,8-11H2