3-[(3-oxidanylidene-8-piperazin-1-yl-1,4-benzoxazin-4-yl)methyl]benzenecarbonitrile

Systemtic Name: 3-[(3-oxidanylidene-8-piperazin-1-yl-1,4-benzoxazin-4-yl)methyl]benzenecarbonitrile Openeye Name: 3-[(3-oxo-8-piperazin-1-yl-1,4-benzoxazin-4-yl)methyl]benzonitrile CAS Name: 3-[[3-oxo-8-(1-piperazinyl)-1,4-benzoxazin-4-yl]methyl]benzonitrile IUPAC Name: 3-[(3-oxo-8-piperazin-1-yl-1,4-benzoxazin-4-yl)methyl]benzonitrile Traditional Name: 3-[(3-keto-8-piperazino-1,4-benzoxazin-4-yl)methyl]benzonitrile Formula: C20H20N4O2 MolecularWeight: 348.3984

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=CC=CC3=C2OCC(=O)N3CC4=CC=CC(=C4)C#N

Isomeric SMILES

C1CN(CCN1)C2=CC=CC3=C2OCC(=O)N3CC4=CC=CC(=C4)C#N

InChI

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