3-[2-oxidanylidene-4-(quinolin-2-yloxymethyl)pyridin-1-yl]-2-pyridin-4-yl-benzenecarbonitrile

Systemtic Name: 3-[2-oxidanylidene-4-(quinolin-2-yloxymethyl)pyridin-1-yl]-2-pyridin-4-yl-benzenecarbonitrile Openeye Name: 3-[2-oxo-4-(2-quinolyloxymethyl)-1-pyridyl]-2-(4-pyridyl)benzonitrile CAS Name: 3-[2-oxo-4-(2-quinolinyloxymethyl)-1-pyridinyl]-2-pyridin-4-ylbenzonitrile IUPAC Name: 3-[2-oxo-4-(quinolin-2-yloxymethyl)pyridin-1-yl]-2-pyridin-4-ylbenzonitrile Traditional Name: 3-[2-keto-4-(2-quinolyloxymethyl)-1-pyridyl]-2-(4-pyridyl)benzonitrile Formula: C27H18N4O2 MolecularWeight: 430.45742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)OCC3=CC(=O)N(C=C3)C4=CC=CC(=C4C5=CC=NC=C5)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)OCC3=CC(=O)N(C=C3)C4=CC=CC(=C4C5=CC=NC=C5)C#N

InChI

InChI=1S/C27H18N4O2/c28-17-22-5-3-7-24(27(22)21-10-13-29-14-11-21)31-15-12-19(16-26(31)32)18-33-25-9-8-20-4-1-2-6-23(20)30-25/h1-16H,18H2