3-oxidanyl-3-(4-phenylphenyl)-2-[(4-phenylpiperazin-1-yl)methyl]propanenitrile

Systemtic Name: 3-oxidanyl-3-(4-phenylphenyl)-2-[(4-phenylpiperazin-1-yl)methyl]propanenitrile Openeye Name: 3-hydroxy-3-(4-phenylphenyl)-2-[(4-phenylpiperazin-1-yl)methyl]propanenitrile CAS Name: 3-hydroxy-3-(4-phenylphenyl)-2-[(4-phenyl-1-piperazinyl)methyl]propanenitrile IUPAC Name: 3-hydroxy-3-(4-phenylphenyl)-2-[(4-phenylpiperazin-1-yl)methyl]propanenitrile Traditional Name: 3-hydroxy-3-(4-phenylphenyl)-2-[(4-phenylpiperazino)methyl]propionitrile Formula: C26H27N3O MolecularWeight: 397.51208

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(C#N)C(C2=CC=C(C=C2)C3=CC=CC=C3)O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC(C#N)C(C2=CC=C(C=C2)C3=CC=CC=C3)O)C4=CC=CC=C4

InChI

InChI=1S/C26H27N3O/c27-19-24(20-28-15-17-29(18-16-28)25-9-5-2-6-10-25)26(30)23-13-11-22(12-14-23)21-7-3-1-4-8-21/h1-14,24,26,30H,15-18,20H2