7-chloranyl-2-oxidanyl-4-oxidanylidene-3-(3-pyridin-3-ylphenyl)-1H-quinoline-6-carbonitrile

Systemtic Name: 7-chloranyl-2-oxidanyl-4-oxidanylidene-3-(3-pyridin-3-ylphenyl)-1H-quinoline-6-carbonitrile Openeye Name: 7-chloro-2-hydroxy-4-oxo-3-[3-(3-pyridyl)phenyl]-1H-quinoline-6-carbonitrile CAS Name: 7-chloro-2-hydroxy-4-oxo-3-[3-(3-pyridinyl)phenyl]-1H-quinoline-6-carbonitrile IUPAC Name: 7-chloro-2-hydroxy-4-oxo-3-(3-pyridin-3-ylphenyl)-1H-quinoline-6-carbonitrile Traditional Name: 7-chloro-2-hydroxy-4-keto-3-[3-(3-pyridyl)phenyl]-1H-quinoline-6-carbonitrile Formula: C21H12ClN3O2 MolecularWeight: 373.79188

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C2=C(NC3=C(C2=O)C=C(C(=C3)Cl)C#N)O)C4=CN=CC=C4

Isomeric SMILES

C1=CC(=CC(=C1)C2=C(NC3=C(C2=O)C=C(C(=C3)Cl)C#N)O)C4=CN=CC=C4

InChI

InChI=1S/C21H12ClN3O2/c22-17-9-18-16(8-15(17)10-23)20(26)19(21(27)25-18)13-4-1-3-12(7-13)14-5-2-6-24-11-14/h1-9,11H,(H2,25,26,27)