ethyl 7-[3-(hydroxymethyl)-1,1-bis(oxidanylidene)-1,2-thiazolidin-2-yl]hept-5-ynoate

Systemtic Name: ethyl 7-[3-(hydroxymethyl)-1,1-bis(oxidanylidene)-1,2-thiazolidin-2-yl]hept-5-ynoate Openeye Name: ethyl 7-[3-(hydroxymethyl)-1,1-dioxo-1,2-thiazolidin-2-yl]hept-5-ynoate CAS Name: 7-[3-(hydroxymethyl)-1,1-dioxo-1,2-thiazolidin-2-yl]-5-heptynoic acid ethyl ester IUPAC Name: ethyl 7-[3-(hydroxymethyl)-1,1-dioxo-1,2-thiazolidin-2-yl]hept-5-ynoate Traditional Name: 7-(1,1-diketo-3-methylol-1,2-thiazolidin-2-yl)hept-5-ynoic acid ethyl ester Formula: C13H21NO5S MolecularWeight: 303.37454

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCC#CCN1C(CCS1(=O)=O)CO

Isomeric SMILES

CCOC(=O)CCCC#CCN1C(CCS1(=O)=O)CO

InChI

InChI=1S/C13H21NO5S/c1-2-19-13(16)7-5-3-4-6-9-14-12(11-15)8-10-20(14,17)18/h12,15H,2-3,5,7-11H2,1H3