2-chloranyl-6-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]benzenecarbonitrile

Systemtic Name: 2-chloranyl-6-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]benzenecarbonitrile Openeye Name: 2-chloro-6-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]benzonitrile CAS Name: 2-chloro-6-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-1-piperazinyl]benzonitrile IUPAC Name: 2-chloro-6-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]benzonitrile Traditional Name: 2-chloro-6-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazino]benzonitrile Formula: C19H18ClN3O4S MolecularWeight: 419.88192

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=CC=C2)Cl)C#N)S(=O)(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1CN(CCN1C2=C(C(=CC=C2)Cl)C#N)S(=O)(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C19H18ClN3O4S/c20-16-2-1-3-17(15(16)13-21)22-6-8-23(9-7-22)28(24,25)14-4-5-18-19(12-14)27-11-10-26-18/h1-5,12H,6-11H2