2-[4-[2-(6,7-dimethyl-1-benzofuran-3-yl)ethanoyl]piperazin-1-yl]pyridine-4-carbonitrile

Systemtic Name: 2-[4-[2-(6,7-dimethyl-1-benzofuran-3-yl)ethanoyl]piperazin-1-yl]pyridine-4-carbonitrile Openeye Name: 2-[4-[2-(6,7-dimethylbenzofuran-3-yl)acetyl]piperazin-1-yl]pyridine-4-carbonitrile CAS Name: 2-[4-[2-(6,7-dimethyl-3-benzofuranyl)-1-oxoethyl]-1-piperazinyl]-4-pyridinecarbonitrile IUPAC Name: 2-[4-[2-(6,7-dimethyl-1-benzofuran-3-yl)acetyl]piperazin-1-yl]pyridine-4-carbonitrile Traditional Name: 2-[4-[2-(6,7-dimethylbenzofuran-3-yl)acetyl]piperazino]isonicotinonitrile Formula: C22H22N4O2 MolecularWeight: 374.43568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CO2)CC(=O)N3CCN(CC3)C4=NC=CC(=C4)C#N)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CO2)CC(=O)N3CCN(CC3)C4=NC=CC(=C4)C#N)C

InChI

InChI=1S/C22H22N4O2/c1-15-3-4-19-18(14-28-22(19)16(15)2)12-21(27)26-9-7-25(8-10-26)20-11-17(13-23)5-6-24-20/h3-6,11,14H,7-10,12H2,1-2H3