4-cyano-N-[4-(3-oxidanylidenepiperazin-1-yl)phenyl]benzamide

Systemtic Name: 4-cyano-N-[4-(3-oxidanylidenepiperazin-1-yl)phenyl]benzamide Openeye Name: 4-cyano-N-[4-(3-oxopiperazin-1-yl)phenyl]benzamide CAS Name: 4-cyano-N-[4-(3-oxo-1-piperazinyl)phenyl]benzamide IUPAC Name: 4-cyano-N-[4-(3-oxopiperazin-1-yl)phenyl]benzamide Traditional Name: 4-cyano-N-[4-(3-ketopiperazino)phenyl]benzamide Formula: C18H16N4O2 MolecularWeight: 320.34524

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1CN(CC(=O)N1)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C18H16N4O2/c19-11-13-1-3-14(4-2-13)18(24)21-15-5-7-16(8-6-15)22-10-9-20-17(23)12-22/h1-8H,9-10,12H2,(H,20,23)(H,21,24)