2-[(7-chloranylquinolin-2-yl)methoxy]-11-oxidanylidene-6H-benzo[c][1]benzoxepine-8-carbonitrile

Systemtic Name: 2-[(7-chloranylquinolin-2-yl)methoxy]-11-oxidanylidene-6H-benzo[c][1]benzoxepine-8-carbonitrile Openeye Name: 2-[(7-chloro-2-quinolyl)methoxy]-11-oxo-6H-benzo[c][1]benzoxepine-8-carbonitrile CAS Name: 2-[(7-chloro-2-quinolinyl)methoxy]-11-oxo-6H-benzo[c][1]benzoxepin-8-carbonitrile IUPAC Name: 2-[(7-chloroquinolin-2-yl)methoxy]-11-oxo-6H-benzo[c][1]benzoxepine-8-carbonitrile Traditional Name: 2-[(7-chloro-2-quinolyl)methoxy]-11-keto-6H-benzo[c][1]benzoxepin-8-carbonitrile Formula: C25H15ClN2O3 MolecularWeight: 426.8512

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC(=C2)C#N)C(=O)C3=C(O1)C=CC(=C3)OCC4=NC5=C(C=CC(=C5)Cl)C=C4

Isomeric SMILES

C1C2=C(C=CC(=C2)C#N)C(=O)C3=C(O1)C=CC(=C3)OCC4=NC5=C(C=CC(=C5)Cl)C=C4

InChI

InChI=1S/C25H15ClN2O3/c26-18-4-2-16-3-5-19(28-23(16)10-18)14-30-20-6-8-24-22(11-20)25(29)21-7-1-15(12-27)9-17(21)13-31-24/h1-11H,13-14H2