2-[4-[(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)methyl]piperazin-1-yl]benzenecarbonitrile

Systemtic Name: 2-[4-[(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)methyl]piperazin-1-yl]benzenecarbonitrile Openeye Name: 2-[4-[(3-oxo-4H-1,4-benzoxazin-6-yl)methyl]piperazin-1-yl]benzonitrile CAS Name: 2-[4-[(3-oxo-4H-1,4-benzoxazin-6-yl)methyl]-1-piperazinyl]benzonitrile IUPAC Name: 2-[4-[(3-oxo-4H-1,4-benzoxazin-6-yl)methyl]piperazin-1-yl]benzonitrile Traditional Name: 2-[4-[(3-keto-4H-1,4-benzoxazin-6-yl)methyl]piperazino]benzonitrile Formula: C20H20N4O2 MolecularWeight: 348.3984

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCC(=O)N3)C4=CC=CC=C4C#N

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCC(=O)N3)C4=CC=CC=C4C#N

InChI

InChI=1S/C20H20N4O2/c21-12-16-3-1-2-4-18(16)24-9-7-23(8-10-24)13-15-5-6-19-17(11-15)22-20(25)14-26-19/h1-6,11H,7-10,13-14H2,(H,22,25)