4-[2,3-bis(oxidanylidene)-4-(phenylmethyl)piperazin-1-yl]benzenecarbonitrile

Systemtic Name: 4-[2,3-bis(oxidanylidene)-4-(phenylmethyl)piperazin-1-yl]benzenecarbonitrile Openeye Name: 4-(4-benzyl-2,3-dioxo-piperazin-1-yl)benzonitrile CAS Name: 4-[2,3-dioxo-4-(phenylmethyl)-1-piperazinyl]benzonitrile IUPAC Name: 4-(4-benzyl-2,3-dioxopiperazin-1-yl)benzonitrile Traditional Name: 4-(4-benzyl-2,3-diketo-piperazino)benzonitrile Formula: C18H15N3O2 MolecularWeight: 305.3306

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C(=O)N1CC2=CC=CC=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1CN(C(=O)C(=O)N1CC2=CC=CC=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C18H15N3O2/c19-12-14-6-8-16(9-7-14)21-11-10-20(17(22)18(21)23)13-15-4-2-1-3-5-15/h1-9H,10-11,13H2