methyl 4-[[[1,1-bis(oxidanylidene)thiolan-3-yl]carbonylamino]methyl]benzoate

Systemtic Name: methyl 4-[[[1,1-bis(oxidanylidene)thiolan-3-yl]carbonylamino]methyl]benzoate Openeye Name: methyl 4-[[(1,1-dioxothiolane-3-carbonyl)amino]methyl]benzoate CAS Name: 4-[[[(1,1-dioxo-3-thiolanyl)-oxomethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(1,1-dioxothiolane-3-carbonyl)amino]methyl]benzoate Traditional Name: 4-[[(1,1-diketothiolane-3-carbonyl)amino]methyl]benzoic acid methyl ester Formula: C14H17NO5S MolecularWeight: 311.35348

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)C2CCS(=O)(=O)C2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)C2CCS(=O)(=O)C2

InChI

InChI=1S/C14H17NO5S/c1-20-14(17)11-4-2-10(3-5-11)8-15-13(16)12-6-7-21(18,19)9-12/h2-5,12H,6-9H2,1H3,(H,15,16)