tert-butyl 7-methoxy-4-oxidanyl-4-propyl-1H-quinoline-2-carboxylate

Systemtic Name: tert-butyl 7-methoxy-4-oxidanyl-4-propyl-1H-quinoline-2-carboxylate Openeye Name: tert-butyl 4-hydroxy-7-methoxy-4-propyl-1H-quinoline-2-carboxylate CAS Name: 4-hydroxy-7-methoxy-4-propyl-1H-quinoline-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-hydroxy-7-methoxy-4-propyl-1H-quinoline-2-carboxylate Traditional Name: 4-hydroxy-7-methoxy-4-propyl-1H-quinoline-2-carboxylic acid tert-butyl ester Formula: C18H25NO4 MolecularWeight: 319.3954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1(C=C(NC2=C1C=CC(=C2)OC)C(=O)OC(C)(C)C)O

Isomeric SMILES

CCCC1(C=C(NC2=C1C=CC(=C2)OC)C(=O)OC(C)(C)C)O

InChI

InChI=1S/C18H25NO4/c1-6-9-18(21)11-15(16(20)23-17(2,3)4)19-14-10-12(22-5)7-8-13(14)18/h7-8,10-11,19,21H,6,9H2,1-5H3