ethyl 4-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-2-methylidene-5-oxidanylidene-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate

Systemtic Name: ethyl 4-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-2-methylidene-5-oxidanylidene-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate Openeye Name: ethyl 4-(3-bromo-4-hydroxy-5-methoxy-phenyl)-2-methylene-5-oxo-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate CAS Name: 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-methylene-5-oxo-1,3,4,6,7,8-hexahydroquinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-methylidene-5-oxo-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate Traditional Name: 4-(3-bromo-4-hydroxy-5-methoxy-phenyl)-5-keto-2-methylene-1,3,4,6,7,8-hexahydroquinoline-3-carboxylic acid ethyl ester Formula: C20H22BrNO5 MolecularWeight: 436.29638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(C2=C(CCCC2=O)NC1=C)C3=CC(=C(C(=C3)Br)O)OC

Isomeric SMILES

CCOC(=O)C1C(C2=C(CCCC2=O)NC1=C)C3=CC(=C(C(=C3)Br)O)OC

InChI

InChI=1S/C20H22BrNO5/c1-4-27-20(25)16-10(2)22-13-6-5-7-14(23)18(13)17(16)11-8-12(21)19(24)15(9-11)26-3/h8-9,16-17,22,24H,2,4-7H2,1,3H3