methyl 2-[[[(1S)-1-(4-fluorophenyl)-2-methyl-propyl]amino]methyl]-4-methyl-quinoline-3-carboxylate

Systemtic Name: methyl 2-[[[(1S)-1-(4-fluorophenyl)-2-methyl-propyl]amino]methyl]-4-methyl-quinoline-3-carboxylate Openeye Name: methyl 2-[[[(1S)-1-(4-fluorophenyl)-2-methyl-propyl]amino]methyl]-4-methyl-quinoline-3-carboxylate CAS Name: 2-[[[(1S)-1-(4-fluorophenyl)-2-methylpropyl]amino]methyl]-4-methyl-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[[[(1S)-1-(4-fluorophenyl)-2-methylpropyl]amino]methyl]-4-methylquinoline-3-carboxylate Traditional Name: 2-[[[(1S)-1-(4-fluorophenyl)-2-methyl-propyl]amino]methyl]-4-methyl-quinoline-3-carboxylic acid methyl ester Formula: C23H25FN2O2 MolecularWeight: 380.455203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)CNC(C3=CC=C(C=C3)F)C(C)C)C(=O)OC

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)CN[C@H](C3=CC=C(C=C3)F)C(C)C)C(=O)OC

InChI

InChI=1S/C23H25FN2O2/c1-14(2)22(16-9-11-17(24)12-10-16)25-13-20-21(23(27)28-4)15(3)18-7-5-6-8-19(18)26-20/h5-12,14,22,25H,13H2,1-4H3/t22-/m0/s1