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

Systemtic Name: hexyl 4-[[(4-fluorophenyl)-(2-methyl-8-oxidanyl-quinolin-7-yl)methyl]amino]benzoate Openeye Name: hexyl 4-[[(4-fluorophenyl)-(8-hydroxy-2-methyl-7-quinolyl)methyl]amino]benzoate CAS Name: 4-[[(4-fluorophenyl)-(8-hydroxy-2-methyl-7-quinolinyl)methyl]amino]benzoic acid hexyl ester IUPAC Name: hexyl 4-[[(4-fluorophenyl)-(8-hydroxy-2-methylquinolin-7-yl)methyl]amino]benzoate Traditional Name: 4-[[(4-fluorophenyl)-(8-hydroxy-2-methyl-7-quinolyl)methyl]amino]benzoic acid hexyl ester Formula: C30H31FN2O3 MolecularWeight: 486.577143

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=CC=C(C=C1)NC(C2=CC=C(C=C2)F)C3=C(C4=C(C=CC(=N4)C)C=C3)O

Isomeric SMILES

CCCCCCOC(=O)C1=CC=C(C=C1)NC(C2=CC=C(C=C2)F)C3=C(C4=C(C=CC(=N4)C)C=C3)O

InChI

InChI=1S/C30H31FN2O3/c1-3-4-5-6-19-36-30(35)23-11-16-25(17-12-23)33-27(21-9-14-24(31)15-10-21)26-18-13-22-8-7-20(2)32-28(22)29(26)34/h7-18,27,33-34H,3-6,19H2,1-2H3