2-[4-[2-(5-ethanoyl-2-methoxy-phenyl)ethanoyl]piperazin-1-yl]pyridine-3-carbonitrile

Systemtic Name: 2-[4-[2-(5-ethanoyl-2-methoxy-phenyl)ethanoyl]piperazin-1-yl]pyridine-3-carbonitrile Openeye Name: 2-[4-[2-(5-acetyl-2-methoxy-phenyl)acetyl]piperazin-1-yl]pyridine-3-carbonitrile CAS Name: 2-[4-[2-(5-acetyl-2-methoxyphenyl)-1-oxoethyl]-1-piperazinyl]-3-pyridinecarbonitrile IUPAC Name: 2-[4-[2-(5-acetyl-2-methoxyphenyl)acetyl]piperazin-1-yl]pyridine-3-carbonitrile Traditional Name: 2-[4-[2-(5-acetyl-2-methoxy-phenyl)acetyl]piperazino]nicotinonitrile Formula: C21H22N4O3 MolecularWeight: 378.42438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)CC(=O)N2CCN(CC2)C3=C(C=CC=N3)C#N

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)CC(=O)N2CCN(CC2)C3=C(C=CC=N3)C#N

InChI

InChI=1S/C21H22N4O3/c1-15(26)16-5-6-19(28-2)18(12-16)13-20(27)24-8-10-25(11-9-24)21-17(14-22)4-3-7-23-21/h3-7,12H,8-11,13H2,1-2H3