3-[4-[(2-oxidanyl-5-phenyl-phenyl)methyl]piperazin-1-yl]propanenitrile

Systemtic Name: 3-[4-[(2-oxidanyl-5-phenyl-phenyl)methyl]piperazin-1-yl]propanenitrile Openeye Name: 3-[4-[(2-hydroxy-5-phenyl-phenyl)methyl]piperazin-1-yl]propanenitrile CAS Name: 3-[4-[(2-hydroxy-5-phenylphenyl)methyl]-1-piperazinyl]propanenitrile IUPAC Name: 3-[4-[(2-hydroxy-5-phenylphenyl)methyl]piperazin-1-yl]propanenitrile Traditional Name: 3-[4-(2-hydroxy-5-phenyl-benzyl)piperazino]propionitrile Formula: C20H23N3O MolecularWeight: 321.41612

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC#N)CC2=C(C=CC(=C2)C3=CC=CC=C3)O

Isomeric SMILES

C1CN(CCN1CCC#N)CC2=C(C=CC(=C2)C3=CC=CC=C3)O

InChI

InChI=1S/C20H23N3O/c21-9-4-10-22-11-13-23(14-12-22)16-19-15-18(7-8-20(19)24)17-5-2-1-3-6-17/h1-3,5-8,15,24H,4,10-14,16H2