5-(3-oxidanylidene-4-pyridin-4-yl-1,2-oxazol-5-yl)-2-(quinolin-2-ylmethoxy)benzenecarbonitrile

Systemtic Name: 5-(3-oxidanylidene-4-pyridin-4-yl-1,2-oxazol-5-yl)-2-(quinolin-2-ylmethoxy)benzenecarbonitrile Openeye Name: 5-[3-oxo-4-(4-pyridyl)isoxazol-5-yl]-2-(2-quinolylmethoxy)benzonitrile CAS Name: 5-(3-oxo-4-pyridin-4-yl-5-isoxazolyl)-2-(2-quinolinylmethoxy)benzonitrile IUPAC Name: 5-(3-oxo-4-pyridin-4-yl-1,2-oxazol-5-yl)-2-(quinolin-2-ylmethoxy)benzonitrile Traditional Name: 5-[3-keto-4-(4-pyridyl)-4-isoxazolin-5-yl]-2-(2-quinolylmethoxy)benzonitrile Formula: C25H16N4O3 MolecularWeight: 420.41954

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)COC3=C(C=C(C=C3)C4=C(C(=O)NO4)C5=CC=NC=C5)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)COC3=C(C=C(C=C3)C4=C(C(=O)NO4)C5=CC=NC=C5)C#N

InChI

InChI=1S/C25H16N4O3/c26-14-19-13-18(24-23(25(30)29-32-24)17-9-11-27-12-10-17)6-8-22(19)31-15-20-7-5-16-3-1-2-4-21(16)28-20/h1-13H,15H2,(H,29,30)