ethyl 4-[3-[[2-(3-fluorophenyl)ethylamino]methyl]-6-methyl-quinolin-2-yl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[3-[[2-(3-fluorophenyl)ethylamino]methyl]-6-methyl-quinolin-2-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[3-[[2-(3-fluorophenyl)ethylamino]methyl]-6-methyl-2-quinolyl]piperazine-1-carboxylate CAS Name: 4-[3-[[2-(3-fluorophenyl)ethylamino]methyl]-6-methyl-2-quinolinyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-[[2-(3-fluorophenyl)ethylamino]methyl]-6-methylquinolin-2-yl]piperazine-1-carboxylate Traditional Name: 4-[3-[[2-(3-fluorophenyl)ethylamino]methyl]-6-methyl-2-quinolyl]piperazine-1-carboxylic acid ethyl ester Formula: C26H31FN4O2 MolecularWeight: 450.548343

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=C(C=C3C=C(C=CC3=N2)C)CNCCC4=CC(=CC=C4)F

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=C(C=C3C=C(C=CC3=N2)C)CNCCC4=CC(=CC=C4)F

InChI

InChI=1S/C26H31FN4O2/c1-3-33-26(32)31-13-11-30(12-14-31)25-22(17-21-15-19(2)7-8-24(21)29-25)18-28-10-9-20-5-4-6-23(27)16-20/h4-8,15-17,28H,3,9-14,18H2,1-2H3