(E)-4-[[1,1-bis(oxidanylidene)thiolan-3-yl]-butan-2-yl-amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[[1,1-bis(oxidanylidene)thiolan-3-yl]-butan-2-yl-amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[(1,1-dioxothiolan-3-yl)-sec-butyl-amino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[butan-2-yl-(1,1-dioxo-3-thiolanyl)amino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[butan-2-yl-(1,1-dioxothiolan-3-yl)amino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-[(1,1-diketothiolan-3-yl)-sec-butyl-amino]-4-keto-but-2-enoic acid Formula: C12H19NO5S MolecularWeight: 289.34796

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(C1CCS(=O)(=O)C1)C(=O)C=CC(=O)O

Isomeric SMILES

CCC(C)N(C1CCS(=O)(=O)C1)C(=O)/C=C/C(=O)O

InChI

InChI=1S/C12H19NO5S/c1-3-9(2)13(11(14)4-5-12(15)16)10-6-7-19(17,18)8-10/h4-5,9-10H,3,6-8H2,1-2H3,(H,15,16)/b5-4+