methyl 2-(5-oxidanylidene-6H-benzo[b][1]benzoxepin-2-yl)propanoate

Systemtic Name: methyl 2-(5-oxidanylidene-6H-benzo[b][1]benzoxepin-2-yl)propanoate Openeye Name: methyl 2-(5-oxo-6H-benzo[b][1]benzoxepin-2-yl)propanoate CAS Name: 2-(5-oxo-6H-benzo[b][1]benzoxepin-2-yl)propanoic acid methyl ester IUPAC Name: methyl 2-(5-oxo-6H-benzo[b][1]benzoxepin-2-yl)propanoate Traditional Name: 2-(5-keto-6H-benzo[b][1]benzoxepin-2-yl)propionic acid methyl ester Formula: C18H16O4 MolecularWeight: 296.31724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)C(=O)CC3=CC=CC=C3O2)C(=O)OC

Isomeric SMILES

CC(C1=CC2=C(C=C1)C(=O)CC3=CC=CC=C3O2)C(=O)OC

InChI

InChI=1S/C18H16O4/c1-11(18(20)21-2)12-7-8-14-15(19)9-13-5-3-4-6-16(13)22-17(14)10-12/h3-8,10-11H,9H2,1-2H3