methyl 4-[3-[[2-(2-fluorophenyl)-2-oxidanyl-ethyl]amino]pentyl]benzoate

Systemtic Name: methyl 4-[3-[[2-(2-fluorophenyl)-2-oxidanyl-ethyl]amino]pentyl]benzoate Openeye Name: methyl 4-[3-[[2-(2-fluorophenyl)-2-hydroxy-ethyl]amino]pentyl]benzoate CAS Name: 4-[3-[[2-(2-fluorophenyl)-2-hydroxyethyl]amino]pentyl]benzoic acid methyl ester IUPAC Name: methyl 4-[3-[[2-(2-fluorophenyl)-2-hydroxyethyl]amino]pentyl]benzoate Traditional Name: 4-[3-[[2-(2-fluorophenyl)-2-hydroxy-ethyl]amino]pentyl]benzoic acid methyl ester Formula: C21H26FNO3 MolecularWeight: 359.434443

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC1=CC=C(C=C1)C(=O)OC)NCC(C2=CC=CC=C2F)O

Isomeric SMILES

CCC(CCC1=CC=C(C=C1)C(=O)OC)NCC(C2=CC=CC=C2F)O

InChI

InChI=1S/C21H26FNO3/c1-3-17(23-14-20(24)18-6-4-5-7-19(18)22)13-10-15-8-11-16(12-9-15)21(25)26-2/h4-9,11-12,17,20,23-24H,3,10,13-14H2,1-2H3