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

Systemtic Name: 4-[(3-chlorophenyl)methoxy]-6-methoxy-2-methyl-2-phenylsulfanyl-morpholine-3-carboxylic acid Openeye Name: 4-[(3-chlorophenyl)methoxy]-6-methoxy-2-methyl-2-phenylsulfanyl-morpholine-3-carboxylic acid CAS Name: 4-[(3-chlorophenyl)methoxy]-6-methoxy-2-methyl-2-(phenylthio)-3-morpholinecarboxylic acid IUPAC Name: 4-[(3-chlorophenyl)methoxy]-6-methoxy-2-methyl-2-phenylsulfanylmorpholine-3-carboxylic acid Traditional Name: 4-(3-chlorobenzyl)oxy-6-methoxy-2-methyl-2-(phenylthio)morpholine-3-carboxylic acid Formula: C20H22ClNO5S MolecularWeight: 423.91038

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N(CC(O1)OC)OCC2=CC(=CC=C2)Cl)C(=O)O)SC3=CC=CC=C3

Isomeric SMILES

CC1(C(N(CC(O1)OC)OCC2=CC(=CC=C2)Cl)C(=O)O)SC3=CC=CC=C3

InChI

InChI=1S/C20H22ClNO5S/c1-20(28-16-9-4-3-5-10-16)18(19(23)24)22(12-17(25-2)27-20)26-13-14-7-6-8-15(21)11-14/h3-11,17-18H,12-13H2,1-2H3,(H,23,24)