methyl 4-(4-but-2-ynoxyphenoxy)sulfinyl-2,2-dimethyl-thiomorpholine-3-carboxylate

Systemtic Name: methyl 4-(4-but-2-ynoxyphenoxy)sulfinyl-2,2-dimethyl-thiomorpholine-3-carboxylate Openeye Name: methyl 4-(4-but-2-ynoxyphenoxy)sulfinyl-2,2-dimethyl-thiomorpholine-3-carboxylate CAS Name: 4-(4-but-2-ynoxyphenoxy)sulfinyl-2,2-dimethyl-3-thiomorpholinecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-but-2-ynoxyphenoxy)sulfinyl-2,2-dimethylthiomorpholine-3-carboxylate Traditional Name: 4-(4-but-2-ynoxyphenoxy)sulfinyl-2,2-dimethyl-thiomorpholine-3-carboxylic acid methyl ester Formula: C18H23NO5S2 MolecularWeight: 397.50892

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=CC=C(C=C1)OS(=O)N2CCSC(C2C(=O)OC)(C)C

Isomeric SMILES

CC#CCOC1=CC=C(C=C1)OS(=O)N2CCSC(C2C(=O)OC)(C)C

InChI

InChI=1S/C18H23NO5S2/c1-5-6-12-23-14-7-9-15(10-8-14)24-26(21)19-11-13-25-18(2,3)16(19)17(20)22-4/h7-10,16H,11-13H2,1-4H3