(E)-3-oxidanyl-2-phenyl-4-(4-phenylpiperazin-1-yl)but-2-enenitrile

Systemtic Name: (E)-3-oxidanyl-2-phenyl-4-(4-phenylpiperazin-1-yl)but-2-enenitrile Openeye Name: (E)-3-hydroxy-2-phenyl-4-(4-phenylpiperazin-1-yl)but-2-enenitrile CAS Name: (E)-3-hydroxy-2-phenyl-4-(4-phenyl-1-piperazinyl)-2-butenenitrile IUPAC Name: (E)-3-hydroxy-2-phenyl-4-(4-phenylpiperazin-1-yl)but-2-enenitrile Traditional Name: (E)-3-hydroxy-2-phenyl-4-(4-phenylpiperazino)but-2-enenitrile Formula: C20H21N3O MolecularWeight: 319.40024

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1CN(CCN1C/C(=C(\C#N)/C2=CC=CC=C2)/O)C3=CC=CC=C3

InChI

InChI=1S/C20H21N3O/c21-15-19(17-7-3-1-4-8-17)20(24)16-22-11-13-23(14-12-22)18-9-5-2-6-10-18/h1-10,24H,11-14,16H2/b20-19-