5-spiro[4H-1,3-benzodioxine-2,4'-oxane]-6-ylquinoline

Systemtic Name: 5-spiro[4H-1,3-benzodioxine-2,4'-oxane]-6-ylquinoline Openeye Name: 5-spiro[4H-1,3-benzodioxine-2,4'-tetrahydropyran]-6-ylquinoline CAS Name: 5-(6-spiro[4H-1,3-benzodioxin-2,4'-oxane]yl)quinoline IUPAC Name: 5-spiro[4H-1,3-benzodioxine-2,4'-oxane]-6-ylquinoline Traditional Name: 5-spiro[4H-1,3-benzodioxin-2,4'-tetrahydropyran]-6-ylquinoline Formula: C21H19NO3 MolecularWeight: 333.38046

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCC12OCC3=C(O2)C=CC(=C3)C4=C5C=CC=NC5=CC=C4

Isomeric SMILES

C1COCCC12OCC3=C(O2)C=CC(=C3)C4=C5C=CC=NC5=CC=C4

InChI

InChI=1S/C21H19NO3/c1-3-17(18-4-2-10-22-19(18)5-1)15-6-7-20-16(13-15)14-24-21(25-20)8-11-23-12-9-21/h1-7,10,13H,8-9,11-12,14H2