4-[2-[[1,1-bis(oxidanylidene)thiolan-3-yl]-methyl-amino]ethoxy]benzoic acid

Systemtic Name: 4-[2-[[1,1-bis(oxidanylidene)thiolan-3-yl]-methyl-amino]ethoxy]benzoic acid Openeye Name: 4-[2-[(1,1-dioxothiolan-3-yl)-methyl-amino]ethoxy]benzoic acid CAS Name: 4-[2-[(1,1-dioxo-3-thiolanyl)-methylamino]ethoxy]benzoic acid IUPAC Name: 4-[2-[(1,1-dioxothiolan-3-yl)-methylamino]ethoxy]benzoic acid Traditional Name: 4-[2-[(1,1-diketothiolan-3-yl)-methyl-amino]ethoxy]benzoic acid Formula: C14H19NO5S MolecularWeight: 313.36936

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCOC1=CC=C(C=C1)C(=O)O)C2CCS(=O)(=O)C2

Isomeric SMILES

CN(CCOC1=CC=C(C=C1)C(=O)O)C2CCS(=O)(=O)C2

InChI

InChI=1S/C14H19NO5S/c1-15(12-6-9-21(18,19)10-12)7-8-20-13-4-2-11(3-5-13)14(16)17/h2-5,12H,6-10H2,1H3,(H,16,17)