(6-chloranyl-4-oxidanyl-2,3-dipropoxy-naphthalen-1-yl) 4-fluoranylbenzoate

Systemtic Name: (6-chloranyl-4-oxidanyl-2,3-dipropoxy-naphthalen-1-yl) 4-fluoranylbenzoate Openeye Name: (6-chloro-4-hydroxy-2,3-dipropoxy-1-naphthyl) 4-fluorobenzoate CAS Name: 4-fluorobenzoic acid (6-chloro-4-hydroxy-2,3-dipropoxy-1-naphthalenyl) ester IUPAC Name: (6-chloro-4-hydroxy-2,3-dipropoxynaphthalen-1-yl) 4-fluorobenzoate Traditional Name: 4-fluorobenzoic acid (6-chloro-4-hydroxy-2,3-dipropoxy-1-naphthyl) ester Formula: C23H22ClFO5 MolecularWeight: 432.869183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C2=C(C=CC(=C2)Cl)C(=C1OCCC)OC(=O)C3=CC=C(C=C3)F)O

Isomeric SMILES

CCCOC1=C(C2=C(C=CC(=C2)Cl)C(=C1OCCC)OC(=O)C3=CC=C(C=C3)F)O

InChI

InChI=1S/C23H22ClFO5/c1-3-11-28-21-19(26)18-13-15(24)7-10-17(18)20(22(21)29-12-4-2)30-23(27)14-5-8-16(25)9-6-14/h5-10,13,26H,3-4,11-12H2,1-2H3