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

Systemtic Name: (2R)-2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-3-phenyl-propanoate Openeye Name: (2R)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-3-phenyl-propanoate CAS Name: (2R)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-3-phenylpropanoate IUPAC Name: (2R)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-3-phenylpropanoate Traditional Name: (2R)-2-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]-3-phenyl-propionate Formula: C16H13N2O4S- MolecularWeight: 329.35042

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)[O-])NC2=NS(=O)(=O)C3=CC=CC=C32

Isomeric SMILES

C1=CC=C(C=C1)C[C@H](C(=O)[O-])NC2=NS(=O)(=O)C3=CC=CC=C32

InChI

InChI=1S/C16H14N2O4S/c19-16(20)13(10-11-6-2-1-3-7-11)17-15-12-8-4-5-9-14(12)23(21,22)18-15/h1-9,13H,10H2,(H,17,18)(H,19,20)/p-1/t13-/m1/s1