6-butyl-4-oxidanylidene-1H-quinoline-3-carbonitrile

Systemtic Name: 6-butyl-4-oxidanylidene-1H-quinoline-3-carbonitrile Openeye Name: 6-butyl-4-oxo-1H-quinoline-3-carbonitrile CAS Name: 6-butyl-4-oxo-1H-quinoline-3-carbonitrile IUPAC Name: 6-butyl-4-oxo-1H-quinoline-3-carbonitrile Traditional Name: 6-butyl-4-keto-1H-quinoline-3-carbonitrile Formula: C14H14N2O MolecularWeight: 226.27376

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)NC=C(C2=O)C#N

Isomeric SMILES

CCCCC1=CC2=C(C=C1)NC=C(C2=O)C#N

InChI

InChI=1S/C14H14N2O/c1-2-3-4-10-5-6-13-12(7-10)14(17)11(8-15)9-16-13/h5-7,9H,2-4H2,1H3,(H,16,17)