ethyl (2R)-3-phenyl-2-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]propanoate

Systemtic Name: ethyl (2R)-3-phenyl-2-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]propanoate Openeye Name: ethyl (2R)-3-phenyl-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propanoate CAS Name: (2R)-3-phenyl-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propanoic acid ethyl ester IUPAC Name: ethyl (2R)-3-phenyl-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propanoate Traditional Name: (2R)-3-phenyl-2-(1,1,3-triketo-1,2-benzothiazol-2-yl)propionic acid ethyl ester Formula: C18H17NO5S MolecularWeight: 359.39628

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=CC=C1)N2C(=O)C3=CC=CC=C3S2(=O)=O

Isomeric SMILES

CCOC(=O)[C@@H](CC1=CC=CC=C1)N2C(=O)C3=CC=CC=C3S2(=O)=O

InChI

InChI=1S/C18H17NO5S/c1-2-24-18(21)15(12-13-8-4-3-5-9-13)19-17(20)14-10-6-7-11-16(14)25(19,22)23/h3-11,15H,2,12H2,1H3/t15-/m1/s1