5-oxidanyl-2-(4-phenethylpiperazin-1-yl)benzenecarbonitrile

Systemtic Name: 5-oxidanyl-2-(4-phenethylpiperazin-1-yl)benzenecarbonitrile Openeye Name: 5-hydroxy-2-(4-phenethylpiperazin-1-yl)benzonitrile CAS Name: 5-hydroxy-2-(4-phenethyl-1-piperazinyl)benzonitrile IUPAC Name: 5-hydroxy-2-(4-phenethylpiperazin-1-yl)benzonitrile Traditional Name: 5-hydroxy-2-(4-phenethylpiperazino)benzonitrile Formula: C19H21N3O MolecularWeight: 307.38954

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC2=CC=CC=C2)C3=C(C=C(C=C3)O)C#N

Isomeric SMILES

C1CN(CCN1CCC2=CC=CC=C2)C3=C(C=C(C=C3)O)C#N

InChI

InChI=1S/C19H21N3O/c20-15-17-14-18(23)6-7-19(17)22-12-10-21(11-13-22)9-8-16-4-2-1-3-5-16/h1-7,14,23H,8-13H2