methyl 3-[[6-fluoranyl-1,1-bis(oxidanylidene)-3,4-dihydro-2H-thiochromen-4-yl]amino]propanoate

Systemtic Name: methyl 3-[[6-fluoranyl-1,1-bis(oxidanylidene)-3,4-dihydro-2H-thiochromen-4-yl]amino]propanoate Openeye Name: methyl 3-[(6-fluoro-1,1-dioxo-3,4-dihydro-2H-thiochromen-4-yl)amino]propanoate CAS Name: 3-[(6-fluoro-1,1-dioxo-3,4-dihydro-2H-1-benzothiopyran-4-yl)amino]propanoic acid methyl ester IUPAC Name: methyl 3-[(6-fluoro-1,1-dioxo-3,4-dihydro-2H-thiochromen-4-yl)amino]propanoate Traditional Name: 3-[(6-fluoro-1,1-diketo-3,4-dihydro-2H-thiochromen-4-yl)amino]propionic acid methyl ester Formula: C13H16FNO4S MolecularWeight: 301.333843

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCNC1CCS(=O)(=O)C2=C1C=C(C=C2)F

Isomeric SMILES

COC(=O)CCNC1CCS(=O)(=O)C2=C1C=C(C=C2)F

InChI

InChI=1S/C13H16FNO4S/c1-19-13(16)4-6-15-11-5-7-20(17,18)12-3-2-9(14)8-10(11)12/h2-3,8,11,15H,4-7H2,1H3