methyl 2-(4-fluorophenyl)-4-[(1-methyl-4-methylsulfanyl-pyrrolidin-2-yl)methoxy]benzoate

Systemtic Name: methyl 2-(4-fluorophenyl)-4-[(1-methyl-4-methylsulfanyl-pyrrolidin-2-yl)methoxy]benzoate Openeye Name: methyl 2-(4-fluorophenyl)-4-[(1-methyl-4-methylsulfanyl-pyrrolidin-2-yl)methoxy]benzoate CAS Name: 2-(4-fluorophenyl)-4-[[1-methyl-4-(methylthio)-2-pyrrolidinyl]methoxy]benzoic acid methyl ester IUPAC Name: methyl 2-(4-fluorophenyl)-4-[(1-methyl-4-methylsulfanylpyrrolidin-2-yl)methoxy]benzoate Traditional Name: 2-(4-fluorophenyl)-4-[[1-methyl-4-(methylthio)pyrrolidin-2-yl]methoxy]benzoic acid methyl ester Formula: C21H24FNO3S MolecularWeight: 389.483563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CC(CC1COC2=CC(=C(C=C2)C(=O)OC)C3=CC=C(C=C3)F)SC

Isomeric SMILES

CN1CC(CC1COC2=CC(=C(C=C2)C(=O)OC)C3=CC=C(C=C3)F)SC

InChI

InChI=1S/C21H24FNO3S/c1-23-12-18(27-3)10-16(23)13-26-17-8-9-19(21(24)25-2)20(11-17)14-4-6-15(22)7-5-14/h4-9,11,16,18H,10,12-13H2,1-3H3