2-[4-[2-(3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoyl]piperazin-1-yl]pyridine-4-carbonitrile

Systemtic Name: 2-[4-[2-(3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoyl]piperazin-1-yl]pyridine-4-carbonitrile Openeye Name: 2-[4-[2-(3-oxo-1,4-benzoxazin-4-yl)acetyl]piperazin-1-yl]pyridine-4-carbonitrile CAS Name: 2-[4-[1-oxo-2-(3-oxo-1,4-benzoxazin-4-yl)ethyl]-1-piperazinyl]-4-pyridinecarbonitrile IUPAC Name: 2-[4-[2-(3-oxo-1,4-benzoxazin-4-yl)acetyl]piperazin-1-yl]pyridine-4-carbonitrile Traditional Name: 2-[4-[2-(3-keto-1,4-benzoxazin-4-yl)acetyl]piperazino]isonicotinonitrile Formula: C20H19N5O3 MolecularWeight: 377.39656

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC(=C2)C#N)C(=O)CN3C(=O)COC4=CC=CC=C43

Isomeric SMILES

C1CN(CCN1C2=NC=CC(=C2)C#N)C(=O)CN3C(=O)COC4=CC=CC=C43

InChI

InChI=1S/C20H19N5O3/c21-12-15-5-6-22-18(11-15)23-7-9-24(10-8-23)19(26)13-25-16-3-1-2-4-17(16)28-14-20(25)27/h1-6,11H,7-10,13-14H2