3-[3-(6-propan-2-ylquinolin-8-yl)phenyl]-2-pyridin-4-yl-oxirane-2-carbonitrile

Systemtic Name: 3-[3-(6-propan-2-ylquinolin-8-yl)phenyl]-2-pyridin-4-yl-oxirane-2-carbonitrile Openeye Name: 3-[3-(6-isopropyl-8-quinolyl)phenyl]-2-(4-pyridyl)oxirane-2-carbonitrile CAS Name: 3-[3-(6-propan-2-yl-8-quinolinyl)phenyl]-2-pyridin-4-yl-2-oxiranecarbonitrile IUPAC Name: 3-[3-(6-propan-2-ylquinolin-8-yl)phenyl]-2-pyridin-4-yloxirane-2-carbonitrile Traditional Name: 3-[3-(6-isopropyl-8-quinolyl)phenyl]-2-(4-pyridyl)oxirane-2-carbonitrile Formula: C26H21N3O MolecularWeight: 391.46444

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C2C(=C1)C=CC=N2)C3=CC(=CC=C3)C4C(O4)(C#N)C5=CC=NC=C5

Isomeric SMILES

CC(C)C1=CC(=C2C(=C1)C=CC=N2)C3=CC(=CC=C3)C4C(O4)(C#N)C5=CC=NC=C5

InChI

InChI=1S/C26H21N3O/c1-17(2)21-14-19-7-4-10-29-24(19)23(15-21)18-5-3-6-20(13-18)25-26(16-27,30-25)22-8-11-28-12-9-22/h3-15,17,25H,1-2H3