2-[[4-(3-chloranylquinoxalin-2-yl)piperazin-1-yl]methylidene]propanedinitrile

Systemtic Name: 2-[[4-(3-chloranylquinoxalin-2-yl)piperazin-1-yl]methylidene]propanedinitrile Openeye Name: 2-[[4-(3-chloroquinoxalin-2-yl)piperazin-1-yl]methylene]propanedinitrile CAS Name: 2-[[4-(3-chloro-2-quinoxalinyl)-1-piperazinyl]methylidene]propanedinitrile IUPAC Name: 2-[[4-(3-chloroquinoxalin-2-yl)piperazin-1-yl]methylidene]propanedinitrile Traditional Name: 2-[[4-(3-chloroquinoxalin-2-yl)piperazino]methylene]malononitrile Formula: C16H13ClN6 MolecularWeight: 324.76762

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C=C(C#N)C#N)C2=NC3=CC=CC=C3N=C2Cl

Isomeric SMILES

C1CN(CCN1C=C(C#N)C#N)C2=NC3=CC=CC=C3N=C2Cl

InChI

InChI=1S/C16H13ClN6/c17-15-16(21-14-4-2-1-3-13(14)20-15)23-7-5-22(6-8-23)11-12(9-18)10-19/h1-4,11H,5-8H2