9-tert-butyl-7-methoxy-3,4-dihydro-2H-1-benzoxepin-5-one

Systemtic Name: 9-tert-butyl-7-methoxy-3,4-dihydro-2H-1-benzoxepin-5-one Openeye Name: 9-tert-butyl-7-methoxy-3,4-dihydro-2H-1-benzoxepin-5-one CAS Name: 9-tert-butyl-7-methoxy-3,4-dihydro-2H-1-benzoxepin-5-one IUPAC Name: 9-tert-butyl-7-methoxy-3,4-dihydro-2H-1-benzoxepin-5-one Traditional Name: 9-tert-butyl-7-methoxy-3,4-dihydro-2H-1-benzoxepin-5-one Formula: C15H20O3 MolecularWeight: 248.3175

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C2C(=CC(=C1)OC)C(=O)CCCO2

Isomeric SMILES

CC(C)(C)C1=C2C(=CC(=C1)OC)C(=O)CCCO2

InChI

InChI=1S/C15H20O3/c1-15(2,3)12-9-10(17-4)8-11-13(16)6-5-7-18-14(11)12/h8-9H,5-7H2,1-4H3