spiro[3H-1,3-benzoxazine-2,1'-cyclododecane]-4-one

Systemtic Name: spiro[3H-1,3-benzoxazine-2,1'-cyclododecane]-4-one Openeye Name: spiro[3H-1,3-benzoxazine-2,1'-cyclododecane]-4-one CAS Name: 4-spiro[3H-1,3-benzoxazine-2,1'-cyclododecane]one IUPAC Name: spiro[3H-1,3-benzoxazine-2,1'-cyclododecane]-4-one Traditional Name: spiro[3H-1,3-benzoxazine-2,1'-cyclododecane]-4-one Formula: C19H27NO2 MolecularWeight: 301.42318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCCCC2(CCCCC1)NC(=O)C3=CC=CC=C3O2

Isomeric SMILES

C1CCCCCC2(CCCCC1)NC(=O)C3=CC=CC=C3O2

InChI

InChI=1S/C19H27NO2/c21-18-16-12-8-9-13-17(16)22-19(20-18)14-10-6-4-2-1-3-5-7-11-15-19/h8-9,12-13H,1-7,10-11,14-15H2,(H,20,21)