ethyl (2S)-2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]propanoate

Systemtic Name: ethyl (2S)-2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]propanoate Openeye Name: ethyl (2S)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]propanoate CAS Name: (2S)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]propanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]propanoate Traditional Name: (2S)-2-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]propionic acid ethyl ester Formula: C12H14N2O4S MolecularWeight: 282.31556

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)NC1=NS(=O)(=O)C2=CC=CC=C21

Isomeric SMILES

CCOC(=O)[C@H](C)NC1=NS(=O)(=O)C2=CC=CC=C21

InChI

InChI=1S/C12H14N2O4S/c1-3-18-12(15)8(2)13-11-9-6-4-5-7-10(9)19(16,17)14-11/h4-8H,3H2,1-2H3,(H,13,14)/t8-/m0/s1