4-(5-oxidanyl-7-oxidanylidene-7-pyridin-3-yl-heptyl)benzenecarbonitrile

Systemtic Name: 4-(5-oxidanyl-7-oxidanylidene-7-pyridin-3-yl-heptyl)benzenecarbonitrile Openeye Name: 4-[5-hydroxy-7-oxo-7-(3-pyridyl)heptyl]benzonitrile CAS Name: 4-[5-hydroxy-7-oxo-7-(3-pyridinyl)heptyl]benzonitrile IUPAC Name: 4-(5-hydroxy-7-oxo-7-pyridin-3-ylheptyl)benzonitrile Traditional Name: 4-[5-hydroxy-7-keto-7-(3-pyridyl)heptyl]benzonitrile Formula: C19H20N2O2 MolecularWeight: 308.3743

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C(=O)CC(CCCCC2=CC=C(C=C2)C#N)O

Isomeric SMILES

C1=CC(=CN=C1)C(=O)CC(CCCCC2=CC=C(C=C2)C#N)O

InChI

InChI=1S/C19H20N2O2/c20-13-16-9-7-15(8-10-16)4-1-2-6-18(22)12-19(23)17-5-3-11-21-14-17/h3,5,7-11,14,18,22H,1-2,4,6,12H2