methyl 3-[[(4-fluorophenyl)-(2-methyl-8-oxidanyl-quinolin-7-yl)methyl]amino]benzoate

Systemtic Name: methyl 3-[[(4-fluorophenyl)-(2-methyl-8-oxidanyl-quinolin-7-yl)methyl]amino]benzoate Openeye Name: methyl 3-[[(4-fluorophenyl)-(8-hydroxy-2-methyl-7-quinolyl)methyl]amino]benzoate CAS Name: 3-[[(4-fluorophenyl)-(8-hydroxy-2-methyl-7-quinolinyl)methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[(4-fluorophenyl)-(8-hydroxy-2-methylquinolin-7-yl)methyl]amino]benzoate Traditional Name: 3-[[(4-fluorophenyl)-(8-hydroxy-2-methyl-7-quinolyl)methyl]amino]benzoic acid methyl ester Formula: C25H21FN2O3 MolecularWeight: 416.444243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C1)C=CC(=C2O)C(C3=CC=C(C=C3)F)NC4=CC=CC(=C4)C(=O)OC

Isomeric SMILES

CC1=NC2=C(C=C1)C=CC(=C2O)C(C3=CC=C(C=C3)F)NC4=CC=CC(=C4)C(=O)OC

InChI

InChI=1S/C25H21FN2O3/c1-15-6-7-17-10-13-21(24(29)23(17)27-15)22(16-8-11-19(26)12-9-16)28-20-5-3-4-18(14-20)25(30)31-2/h3-14,22,28-29H,1-2H3