methyl 3-[4-(2-methyl-2-morpholin-4-yl-propanoyl)phenyl]sulfanylpropanoate

Systemtic Name: methyl 3-[4-(2-methyl-2-morpholin-4-yl-propanoyl)phenyl]sulfanylpropanoate Openeye Name: methyl 3-[4-(2-methyl-2-morpholino-propanoyl)phenyl]sulfanylpropanoate CAS Name: 3-[[4-[2-methyl-2-(4-morpholinyl)-1-oxopropyl]phenyl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[4-(2-methyl-2-morpholin-4-ylpropanoyl)phenyl]sulfanylpropanoate Traditional Name: 3-[[4-(2-methyl-2-morpholino-propanoyl)phenyl]thio]propionic acid methyl ester Formula: C18H25NO4S MolecularWeight: 351.4604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)C1=CC=C(C=C1)SCCC(=O)OC)N2CCOCC2

Isomeric SMILES

CC(C)(C(=O)C1=CC=C(C=C1)SCCC(=O)OC)N2CCOCC2

InChI

InChI=1S/C18H25NO4S/c1-18(2,19-9-11-23-12-10-19)17(21)14-4-6-15(7-5-14)24-13-8-16(20)22-3/h4-7H,8-13H2,1-3H3