ethyl 3-(4-fluorophenyl)-4-oxidanyl-7-oxidanylidene-5,6,8,8a-tetrahydrochromene-2-carboxylate

Systemtic Name: ethyl 3-(4-fluorophenyl)-4-oxidanyl-7-oxidanylidene-5,6,8,8a-tetrahydrochromene-2-carboxylate Openeye Name: ethyl 3-(4-fluorophenyl)-4-hydroxy-7-oxo-5,6,8,8a-tetrahydrochromene-2-carboxylate CAS Name: 3-(4-fluorophenyl)-4-hydroxy-7-oxo-5,6,8,8a-tetrahydro-1-benzopyran-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(4-fluorophenyl)-4-hydroxy-7-oxo-5,6,8,8a-tetrahydrochromene-2-carboxylate Traditional Name: 3-(4-fluorophenyl)-4-hydroxy-7-keto-5,6,8,8a-tetrahydrochromene-2-carboxylic acid ethyl ester Formula: C18H17FO5 MolecularWeight: 332.322983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C2CCC(=O)CC2O1)O)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)C1=C(C(=C2CCC(=O)CC2O1)O)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H17FO5/c1-2-23-18(22)17-15(10-3-5-11(19)6-4-10)16(21)13-8-7-12(20)9-14(13)24-17/h3-6,14,21H,2,7-9H2,1H3