3-piperazin-1-ylsulfonylbenzenecarbonitrile hydrochloride

Systemtic Name: 3-piperazin-1-ylsulfonylbenzenecarbonitrile hydrochloride Openeye Name: 3-piperazin-1-ylsulfonylbenzonitrile hydrochloride CAS Name: 3-(1-piperazinylsulfonyl)benzonitrile hydrochloride IUPAC Name: 3-piperazin-1-ylsulfonylbenzonitrile hydrochloride Traditional Name: 3-piperazinosulfonylbenzonitrile hydrochloride Formula: C11H14ClN3O2S MolecularWeight: 287.76576

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13N3O2S.ClH/c12-9-10-2-1-3-11(8-10)17(15,16)14-6-4-13-5-7-14;/h1-3,8,13H,4-7H2;1H