9-chloranyl-2,4-dimethoxy-6H-benzo[b][1]benzoxepin-5-one

Systemtic Name: 9-chloranyl-2,4-dimethoxy-6H-benzo[b][1]benzoxepin-5-one Openeye Name: 9-chloro-2,4-dimethoxy-6H-benzo[b][1]benzoxepin-5-one CAS Name: 9-chloro-2,4-dimethoxy-6H-benzo[b][1]benzoxepin-5-one IUPAC Name: 9-chloro-2,4-dimethoxy-6H-benzo[b][1]benzoxepin-5-one Traditional Name: 9-chloro-2,4-dimethoxy-6H-benzo[b][1]benzoxepin-5-one Formula: C16H13ClO4 MolecularWeight: 304.72502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C2C(=O)CC3=C(C=C(C=C3)Cl)OC2=C1)OC

Isomeric SMILES

COC1=CC(=C2C(=O)CC3=C(C=C(C=C3)Cl)OC2=C1)OC

InChI

InChI=1S/C16H13ClO4/c1-19-11-7-14(20-2)16-12(18)5-9-3-4-10(17)6-13(9)21-15(16)8-11/h3-4,6-8H,5H2,1-2H3