4-[(4-fluorophenyl)methoxy]-6-(methoxymethyl)-2-methyl-2-phenylsulfanyl-morpholine-3-carboxylic acid

Systemtic Name: 4-[(4-fluorophenyl)methoxy]-6-(methoxymethyl)-2-methyl-2-phenylsulfanyl-morpholine-3-carboxylic acid Openeye Name: 4-[(4-fluorophenyl)methoxy]-6-(methoxymethyl)-2-methyl-2-phenylsulfanyl-morpholine-3-carboxylic acid CAS Name: 4-[(4-fluorophenyl)methoxy]-6-(methoxymethyl)-2-methyl-2-(phenylthio)-3-morpholinecarboxylic acid IUPAC Name: 4-[(4-fluorophenyl)methoxy]-6-(methoxymethyl)-2-methyl-2-phenylsulfanylmorpholine-3-carboxylic acid Traditional Name: 4-(4-fluorobenzyl)oxy-6-(methoxymethyl)-2-methyl-2-(phenylthio)morpholine-3-carboxylic acid Formula: C21H24FNO5S MolecularWeight: 421.482363

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N(CC(O1)COC)OCC2=CC=C(C=C2)F)C(=O)O)SC3=CC=CC=C3

Isomeric SMILES

CC1(C(N(CC(O1)COC)OCC2=CC=C(C=C2)F)C(=O)O)SC3=CC=CC=C3

InChI

InChI=1S/C21H24FNO5S/c1-21(29-18-6-4-3-5-7-18)19(20(24)25)23(12-17(28-21)14-26-2)27-13-15-8-10-16(22)11-9-15/h3-11,17,19H,12-14H2,1-2H3,(H,24,25)