(2R)-2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-3-methyl-butanoate

Systemtic Name: (2R)-2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-3-methyl-butanoate Openeye Name: (2R)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-3-methyl-butanoate CAS Name: (2R)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-3-methylbutanoate IUPAC Name: (2R)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-3-methylbutanoate Traditional Name: (2R)-2-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]-3-methyl-butyrate Formula: C12H13N2O4S- MolecularWeight: 281.30762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)[O-])NC1=NS(=O)(=O)C2=CC=CC=C21

Isomeric SMILES

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

InChI

InChI=1S/C12H14N2O4S/c1-7(2)10(12(15)16)13-11-8-5-3-4-6-9(8)19(17,18)14-11/h3-7,10H,1-2H3,(H,13,14)(H,15,16)/p-1/t10-/m1/s1