2-[2-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]ethoxy]pyridine-4-carbonitrile

Systemtic Name: 2-[2-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]ethoxy]pyridine-4-carbonitrile Openeye Name: 2-[2-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]ethoxy]pyridine-4-carbonitrile CAS Name: 2-[2-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)-1-piperazinyl]ethoxy]-4-pyridinecarbonitrile IUPAC Name: 2-[2-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]ethoxy]pyridine-4-carbonitrile Traditional Name: 2-[2-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazino]ethoxy]isonicotinonitrile Formula: C20H22N4O3 MolecularWeight: 366.41368

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCOC2=NC=CC(=C2)C#N)C3=C4C(=CC=C3)OCCO4

Isomeric SMILES

C1CN(CCN1CCOC2=NC=CC(=C2)C#N)C3=C4C(=CC=C3)OCCO4

InChI

InChI=1S/C20H22N4O3/c21-15-16-4-5-22-19(14-16)26-11-10-23-6-8-24(9-7-23)17-2-1-3-18-20(17)27-13-12-25-18/h1-5,14H,6-13H2