2-butyl-8-oxidanyl-3-oxidanylidene-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile

Systemtic Name: 2-butyl-8-oxidanyl-3-oxidanylidene-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Openeye Name: 2-butyl-8-hydroxy-3-oxo-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile CAS Name: 2-butyl-8-hydroxy-3-oxo-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile IUPAC Name: 2-butyl-8-hydroxy-3-oxo-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Traditional Name: 2-butyl-8-hydroxy-3-keto-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Formula: C14H18N2O2 MolecularWeight: 246.30492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=C2C(CCCC2=C(C1=O)C#N)O

Isomeric SMILES

CCCCN1C=C2C(CCCC2=C(C1=O)C#N)O

InChI

InChI=1S/C14H18N2O2/c1-2-3-7-16-9-12-10(5-4-6-13(12)17)11(8-15)14(16)18/h9,13,17H,2-7H2,1H3