1-(2-hydroxyethyloxy)ethyl 2-(5-oxidanylidene-6H-benzo[b][1]benzoxepin-3-yl)propanoate

Systemtic Name: 1-(2-hydroxyethyloxy)ethyl 2-(5-oxidanylidene-6H-benzo[b][1]benzoxepin-3-yl)propanoate Openeye Name: 1-(2-hydroxyethoxy)ethyl 2-(5-oxo-6H-benzo[b][1]benzoxepin-3-yl)propanoate CAS Name: 2-(5-oxo-6H-benzo[b][1]benzoxepin-3-yl)propanoic acid 1-(2-hydroxyethoxy)ethyl ester IUPAC Name: 1-(2-hydroxyethoxy)ethyl 2-(5-oxo-6H-benzo[b][1]benzoxepin-3-yl)propanoate Traditional Name: 2-(5-keto-6H-benzo[b][1]benzoxepin-3-yl)propionic acid 1-(2-hydroxyethoxy)ethyl ester Formula: C21H22O6 MolecularWeight: 370.39578

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OC3=CC=CC=C3CC2=O)C(=O)OC(C)OCCO

Isomeric SMILES

CC(C1=CC2=C(C=C1)OC3=CC=CC=C3CC2=O)C(=O)OC(C)OCCO

InChI

InChI=1S/C21H22O6/c1-13(21(24)26-14(2)25-10-9-22)15-7-8-20-17(11-15)18(23)12-16-5-3-4-6-19(16)27-20/h3-8,11,13-14,22H,9-10,12H2,1-2H3