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

Systemtic Name: 2-oxidanylidenepropyl 2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]propanoate Openeye Name: acetonyl 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]propanoate CAS Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]propanoic acid 2-oxopropyl ester IUPAC Name: 2-oxopropyl 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]propanoate Traditional Name: 2-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]propionic acid acetonyl ester Formula: C13H14N2O5S MolecularWeight: 310.32566

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14N2O5S/c1-8(16)7-20-13(17)9(2)14-12-10-5-3-4-6-11(10)21(18,19)15-12/h3-6,9H,7H2,1-2H3,(H,14,15)