2-[[4-(2-hydroxyphenyl)piperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 2-[[4-(2-hydroxyphenyl)piperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 2-[[4-(2-hydroxyphenyl)piperazin-1-yl]methyl]benzonitrile CAS Name: 2-[[4-(2-hydroxyphenyl)-1-piperazinyl]methyl]benzonitrile IUPAC Name: 2-[[4-(2-hydroxyphenyl)piperazin-1-yl]methyl]benzonitrile Traditional Name: 2-[[4-(2-hydroxyphenyl)piperazino]methyl]benzonitrile Formula: C18H19N3O MolecularWeight: 293.36296

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2C#N)C3=CC=CC=C3O

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2C#N)C3=CC=CC=C3O

InChI

InChI=1S/C18H19N3O/c19-13-15-5-1-2-6-16(15)14-20-9-11-21(12-10-20)17-7-3-4-8-18(17)22/h1-8,22H,9-12,14H2