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

Systemtic Name: propan-2-yl (2S)-2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]propanoate Openeye Name: isopropyl (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 propan-2-yl ester IUPAC Name: propan-2-yl (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 isopropyl ester Formula: C13H16N2O4S MolecularWeight: 296.34214

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N2O4S/c1-8(2)19-13(16)9(3)14-12-10-6-4-5-7-11(10)20(17,18)15-12/h4-9H,1-3H3,(H,14,15)/t9-/m0/s1