ethyl 6-(morpholin-4-ylmethyl)-4-oxidanylidene-1-(4-propan-2-ylphenyl)quinoline-3-carboxylate

Systemtic Name: ethyl 6-(morpholin-4-ylmethyl)-4-oxidanylidene-1-(4-propan-2-ylphenyl)quinoline-3-carboxylate Openeye Name: ethyl 1-(4-isopropylphenyl)-6-(morpholinomethyl)-4-oxo-quinoline-3-carboxylate CAS Name: 6-(4-morpholinylmethyl)-4-oxo-1-(4-propan-2-ylphenyl)-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-(morpholin-4-ylmethyl)-4-oxo-1-(4-propan-2-ylphenyl)quinoline-3-carboxylate Traditional Name: 4-keto-6-(morpholinomethyl)-1-p-cumenyl-quinoline-3-carboxylic acid ethyl ester Formula: C26H30N2O4 MolecularWeight: 434.5274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=C(C1=O)C=C(C=C2)CN3CCOCC3)C4=CC=C(C=C4)C(C)C

Isomeric SMILES

CCOC(=O)C1=CN(C2=C(C1=O)C=C(C=C2)CN3CCOCC3)C4=CC=C(C=C4)C(C)C

InChI

InChI=1S/C26H30N2O4/c1-4-32-26(30)23-17-28(21-8-6-20(7-9-21)18(2)3)24-10-5-19(15-22(24)25(23)29)16-27-11-13-31-14-12-27/h5-10,15,17-18H,4,11-14,16H2,1-3H3