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

Systemtic Name: 4-(4-methanoylpiperazin-1-yl)sulfonylbenzenecarbonitrile Openeye Name: 4-(4-formylpiperazin-1-yl)sulfonylbenzonitrile CAS Name: 4-[(4-formyl-1-piperazinyl)sulfonyl]benzonitrile IUPAC Name: 4-(4-formylpiperazin-1-yl)sulfonylbenzonitrile Traditional Name: 4-(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=C(C=C2)C#N

Isomeric SMILES

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

InChI

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