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

Systemtic Name: 2-[[4-(3-chlorophenyl)piperazin-1-yl]methyl]-3-oxidanyl-3-(4-phenylphenyl)propanenitrile Openeye Name: 2-[[4-(3-chlorophenyl)piperazin-1-yl]methyl]-3-hydroxy-3-(4-phenylphenyl)propanenitrile CAS Name: 2-[[4-(3-chlorophenyl)-1-piperazinyl]methyl]-3-hydroxy-3-(4-phenylphenyl)propanenitrile IUPAC Name: 2-[[4-(3-chlorophenyl)piperazin-1-yl]methyl]-3-hydroxy-3-(4-phenylphenyl)propanenitrile Traditional Name: 2-[[4-(3-chlorophenyl)piperazino]methyl]-3-hydroxy-3-(4-phenylphenyl)propionitrile Formula: C26H26ClN3O MolecularWeight: 431.95714

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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)Cl

Isomeric SMILES

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

InChI

InChI=1S/C26H26ClN3O/c27-24-7-4-8-25(17-24)30-15-13-29(14-16-30)19-23(18-28)26(31)22-11-9-21(10-12-22)20-5-2-1-3-6-20/h1-12,17,23,26,31H,13-16,19H2