methyl 3-fluoranyl-5-methyl-2-naphthalen-2-yl-6-oxidanyl-4-propyl-benzoate

Systemtic Name: methyl 3-fluoranyl-5-methyl-2-naphthalen-2-yl-6-oxidanyl-4-propyl-benzoate Openeye Name: methyl 5-fluoro-2-hydroxy-3-methyl-6-(2-naphthyl)-4-propyl-benzoate CAS Name: 5-fluoro-2-hydroxy-3-methyl-6-(2-naphthalenyl)-4-propylbenzoic acid methyl ester IUPAC Name: methyl 5-fluoro-2-hydroxy-3-methyl-6-naphthalen-2-yl-4-propylbenzoate Traditional Name: 5-fluoro-2-hydroxy-3-methyl-6-(2-naphthyl)-4-propyl-benzoic acid methyl ester Formula: C22H21FO3 MolecularWeight: 352.398743

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=C(C(=C1C)O)C(=O)OC)C2=CC3=CC=CC=C3C=C2)F

Isomeric SMILES

CCCC1=C(C(=C(C(=C1C)O)C(=O)OC)C2=CC3=CC=CC=C3C=C2)F

InChI

InChI=1S/C22H21FO3/c1-4-7-17-13(2)21(24)19(22(25)26-3)18(20(17)23)16-11-10-14-8-5-6-9-15(14)12-16/h5-6,8-12,24H,4,7H2,1-3H3