4-[[4-(2-phenoxyphenyl)carbonylpiperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-(2-phenoxyphenyl)carbonylpiperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-(2-phenoxybenzoyl)piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[oxo-(2-phenoxyphenyl)methyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-(2-phenoxybenzoyl)piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-(2-phenoxybenzoyl)piperazino]methyl]benzonitrile Formula: C25H23N3O2 MolecularWeight: 397.46902

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)C#N)C(=O)C3=CC=CC=C3OC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)C#N)C(=O)C3=CC=CC=C3OC4=CC=CC=C4

InChI

InChI=1S/C25H23N3O2/c26-18-20-10-12-21(13-11-20)19-27-14-16-28(17-15-27)25(29)23-8-4-5-9-24(23)30-22-6-2-1-3-7-22/h1-13H,14-17,19H2