5-[[2-[(2-fluorophenyl)methoxy]naphthalen-1-yl]methylamino]-2-morpholin-4-yl-benzoic acid

Systemtic Name: 5-[[2-[(2-fluorophenyl)methoxy]naphthalen-1-yl]methylamino]-2-morpholin-4-yl-benzoic acid Openeye Name: 5-[[2-[(2-fluorophenyl)methoxy]-1-naphthyl]methylamino]-2-morpholino-benzoic acid CAS Name: 5-[[2-[(2-fluorophenyl)methoxy]-1-naphthalenyl]methylamino]-2-(4-morpholinyl)benzoic acid IUPAC Name: 5-[[2-[(2-fluorophenyl)methoxy]naphthalen-1-yl]methylamino]-2-morpholin-4-ylbenzoic acid Traditional Name: 5-[[2-(2-fluorobenzyl)oxy-1-naphthyl]methylamino]-2-morpholino-benzoic acid Formula: C29H27FN2O4 MolecularWeight: 486.534083

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)NCC3=C(C=CC4=CC=CC=C43)OCC5=CC=CC=C5F)C(=O)O

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)NCC3=C(C=CC4=CC=CC=C43)OCC5=CC=CC=C5F)C(=O)O

InChI

InChI=1S/C29H27FN2O4/c30-26-8-4-2-6-21(26)19-36-28-12-9-20-5-1-3-7-23(20)25(28)18-31-22-10-11-27(24(17-22)29(33)34)32-13-15-35-16-14-32/h1-12,17,31H,13-16,18-19H2,(H,33,34)