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

Systemtic Name: butan-2-yl 4-(4-methoxy-3-oxidanyl-phenyl)-2-methylidene-5-oxidanylidene-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate Openeye Name: sec-butyl 4-(3-hydroxy-4-methoxy-phenyl)-2-methylene-5-oxo-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate CAS Name: 4-(3-hydroxy-4-methoxyphenyl)-2-methylene-5-oxo-1,3,4,6,7,8-hexahydroquinoline-3-carboxylic acid butan-2-yl ester IUPAC Name: butan-2-yl 4-(3-hydroxy-4-methoxyphenyl)-2-methylidene-5-oxo-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate Traditional Name: 4-(3-hydroxy-4-methoxy-phenyl)-5-keto-2-methylene-1,3,4,6,7,8-hexahydroquinoline-3-carboxylic acid sec-butyl ester Formula: C22H27NO5 MolecularWeight: 385.45348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27NO5/c1-5-12(2)28-22(26)19-13(3)23-15-7-6-8-16(24)21(15)20(19)14-9-10-18(27-4)17(25)11-14/h9-12,19-20,23,25H,3,5-8H2,1-2,4H3