3-(4-methanoylpiperazin-1-yl)sulfonylbenzenecarbonitrile

Systemtic Name: 3-(4-methanoylpiperazin-1-yl)sulfonylbenzenecarbonitrile Openeye Name: 3-(4-formylpiperazin-1-yl)sulfonylbenzonitrile CAS Name: 3-[(4-formyl-1-piperazinyl)sulfonyl]benzonitrile IUPAC Name: 3-(4-formylpiperazin-1-yl)sulfonylbenzonitrile Traditional Name: 3-(4-formylpiperazino)sulfonylbenzonitrile Formula: C12H13N3O3S MolecularWeight: 279.31492

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C=O)S(=O)(=O)C2=CC=CC(=C2)C#N

Isomeric SMILES

C1CN(CCN1C=O)S(=O)(=O)C2=CC=CC(=C2)C#N

InChI

InChI=1S/C12H13N3O3S/c13-9-11-2-1-3-12(8-11)19(17,18)15-6-4-14(10-16)5-7-15/h1-3,8,10H,4-7H2