4-[2-oxidanylidene-2-[4-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]ethoxy]benzenecarbonitrile

Systemtic Name: 4-[2-oxidanylidene-2-[4-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]ethoxy]benzenecarbonitrile Openeye Name: 4-[2-oxo-2-[4-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]ethoxy]benzonitrile CAS Name: 4-[2-oxo-2-[4-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]-1-piperazinyl]ethoxy]benzonitrile IUPAC Name: 4-[2-oxo-2-[4-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]ethoxy]benzonitrile Traditional Name: 4-[2-keto-2-[4-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]piperazino]ethoxy]benzonitrile Formula: C22H21N5O3 MolecularWeight: 403.43384

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC(=NO2)C3=CC=CC=C3)C(=O)COC4=CC=C(C=C4)C#N

Isomeric SMILES

C1CN(CCN1CC2=NC(=NO2)C3=CC=CC=C3)C(=O)COC4=CC=C(C=C4)C#N

InChI

InChI=1S/C22H21N5O3/c23-14-17-6-8-19(9-7-17)29-16-21(28)27-12-10-26(11-13-27)15-20-24-22(25-30-20)18-4-2-1-3-5-18/h1-9H,10-13,15-16H2