2-[4-[(2-oxidanyldibenzofuran-3-yl)methyl]piperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-[(2-oxidanyldibenzofuran-3-yl)methyl]piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-[(2-hydroxydibenzofuran-3-yl)methyl]piperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-[(2-hydroxy-3-dibenzofuranyl)methyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-[(2-hydroxydibenzofuran-3-yl)methyl]piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-[(2-hydroxydibenzofuran-3-yl)methyl]piperazino]sulfonylbenzonitrile Formula: C24H21N3O4S MolecularWeight: 447.50624

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=C(C=C3C4=CC=CC=C4OC3=C2)O)S(=O)(=O)C5=CC=CC=C5C#N

Isomeric SMILES

C1CN(CCN1CC2=C(C=C3C4=CC=CC=C4OC3=C2)O)S(=O)(=O)C5=CC=CC=C5C#N

InChI

InChI=1S/C24H21N3O4S/c25-15-17-5-1-4-8-24(17)32(29,30)27-11-9-26(10-12-27)16-18-13-23-20(14-21(18)28)19-6-2-3-7-22(19)31-23/h1-8,13-14,28H,9-12,16H2