ethyl 4-[5-[(2-chloranyl-4-fluoranyl-phenoxy)methyl]furan-2-yl]-7,7-dimethyl-2-methylidene-5-oxidanylidene-3,4,6,8-tetrahydro-1H-quinoline-3-carboxylate

Systemtic Name: ethyl 4-[5-[(2-chloranyl-4-fluoranyl-phenoxy)methyl]furan-2-yl]-7,7-dimethyl-2-methylidene-5-oxidanylidene-3,4,6,8-tetrahydro-1H-quinoline-3-carboxylate Openeye Name: ethyl 4-[5-[(2-chloro-4-fluoro-phenoxy)methyl]-2-furyl]-7,7-dimethyl-2-methylene-5-oxo-3,4,6,8-tetrahydro-1H-quinoline-3-carboxylate CAS Name: 4-[5-[(2-chloro-4-fluorophenoxy)methyl]-2-furanyl]-7,7-dimethyl-2-methylene-5-oxo-3,4,6,8-tetrahydro-1H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[5-[(2-chloro-4-fluorophenoxy)methyl]furan-2-yl]-7,7-dimethyl-2-methylidene-5-oxo-3,4,6,8-tetrahydro-1H-quinoline-3-carboxylate Traditional Name: 4-[5-[(2-chloro-4-fluoro-phenoxy)methyl]-2-furyl]-5-keto-7,7-dimethyl-2-methylene-3,4,6,8-tetrahydro-1H-quinoline-3-carboxylic acid ethyl ester Formula: C26H27ClFNO5 MolecularWeight: 487.947683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(C2=C(CC(CC2=O)(C)C)NC1=C)C3=CC=C(O3)COC4=C(C=C(C=C4)F)Cl

Isomeric SMILES

CCOC(=O)C1C(C2=C(CC(CC2=O)(C)C)NC1=C)C3=CC=C(O3)COC4=C(C=C(C=C4)F)Cl

InChI

InChI=1S/C26H27ClFNO5/c1-5-32-25(31)22-14(2)29-18-11-26(3,4)12-19(30)23(18)24(22)21-9-7-16(34-21)13-33-20-8-6-15(28)10-17(20)27/h6-10,22,24,29H,2,5,11-13H2,1,3-4H3