5-[4-[3-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxidanyl-propoxy]phenyl]-2-oxidanylidene-1H-pyridine-3-carbonitrile

Systemtic Name: 5-[4-[3-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxidanyl-propoxy]phenyl]-2-oxidanylidene-1H-pyridine-3-carbonitrile Openeye Name: 5-[4-[2-hydroxy-3-[4-(2-methoxyphenyl)piperazin-1-yl]propoxy]phenyl]-2-oxo-1H-pyridine-3-carbonitrile CAS Name: 5-[4-[2-hydroxy-3-[4-(2-methoxyphenyl)-1-piperazinyl]propoxy]phenyl]-2-oxo-1H-pyridine-3-carbonitrile IUPAC Name: 5-[4-[2-hydroxy-3-[4-(2-methoxyphenyl)piperazin-1-yl]propoxy]phenyl]-2-oxo-1H-pyridine-3-carbonitrile Traditional Name: 5-[4-[2-hydroxy-3-[4-(2-methoxyphenyl)piperazino]propoxy]phenyl]-2-keto-1H-pyridine-3-carbonitrile Formula: C26H28N4O4 MolecularWeight: 460.52492

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CC(COC3=CC=C(C=C3)C4=CNC(=O)C(=C4)C#N)O

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)CC(COC3=CC=C(C=C3)C4=CNC(=O)C(=C4)C#N)O

InChI

InChI=1S/C26H28N4O4/c1-33-25-5-3-2-4-24(25)30-12-10-29(11-13-30)17-22(31)18-34-23-8-6-19(7-9-23)21-14-20(15-27)26(32)28-16-21/h2-9,14,16,22,31H,10-13,17-18H2,1H3,(H,28,32)