5-[4-[2-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)ethyl]piperazin-1-yl]-2,3-dihydro-1,4-benzodioxine-7-carbonitrile

Systemtic Name: 5-[4-[2-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)ethyl]piperazin-1-yl]-2,3-dihydro-1,4-benzodioxine-7-carbonitrile Openeye Name: 5-[4-[2-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl]piperazin-1-yl]-2,3-dihydro-1,4-benzodioxine-7-carbonitrile CAS Name: 5-[4-[2-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl]-1-piperazinyl]-2,3-dihydro-1,4-benzodioxin-7-carbonitrile IUPAC Name: 5-[4-[2-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl]piperazin-1-yl]-2,3-dihydro-1,4-benzodioxine-7-carbonitrile Traditional Name: 5-[4-[2-(3-keto-4H-1,4-benzoxazin-6-yl)ethyl]piperazino]-2,3-dihydro-1,4-benzodioxin-7-carbonitrile Formula: C23H24N4O4 MolecularWeight: 420.46106

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC2=CC3=C(C=C2)OCC(=O)N3)C4=C5C(=CC(=C4)C#N)OCCO5

Isomeric SMILES

C1CN(CCN1CCC2=CC3=C(C=C2)OCC(=O)N3)C4=C5C(=CC(=C4)C#N)OCCO5

InChI

InChI=1S/C23H24N4O4/c24-14-17-12-19(23-21(13-17)29-9-10-30-23)27-7-5-26(6-8-27)4-3-16-1-2-20-18(11-16)25-22(28)15-31-20/h1-2,11-13H,3-10,15H2,(H,25,28)