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

Systemtic Name: 2-[4-(2-methoxyethanoyl)piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-(2-methoxyacetyl)piperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-(2-methoxy-1-oxoethyl)-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-(2-methoxyacetyl)piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-(2-methoxyacetyl)piperazino]sulfonylbenzonitrile Formula: C14H17N3O4S MolecularWeight: 323.36748

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Descriptors Computed from Structure

Canonical SMILES:

COCC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C#N

Isomeric SMILES

COCC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C#N

InChI

InChI=1S/C14H17N3O4S/c1-21-11-14(18)16-6-8-17(9-7-16)22(19,20)13-5-3-2-4-12(13)10-15/h2-5H,6-9,11H2,1H3