dimethyl 3-chloranylbenzo[b][1]benzoxepine-5,6-dicarboxylate

Systemtic Name: dimethyl 3-chloranylbenzo[b][1]benzoxepine-5,6-dicarboxylate Openeye Name: dimethyl 3-chlorobenzo[b][1]benzoxepine-5,6-dicarboxylate CAS Name: 3-chlorobenzo[b][1]benzoxepin-5,6-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-chlorobenzo[b][1]benzoxepine-5,6-dicarboxylate Traditional Name: 3-chlorobenzo[b][1]benzoxepin-5,6-dicarboxylic acid dimethyl ester Formula: C18H13ClO5 MolecularWeight: 344.74582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=C(C=CC(=C2)Cl)OC3=CC=CC=C31)C(=O)OC

Isomeric SMILES

COC(=O)C1=C(C2=C(C=CC(=C2)Cl)OC3=CC=CC=C31)C(=O)OC

InChI

InChI=1S/C18H13ClO5/c1-22-17(20)15-11-5-3-4-6-13(11)24-14-8-7-10(19)9-12(14)16(15)18(21)23-2/h3-9H,1-2H3