(4-propan-2-ylphenyl)methyl 2-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]ethanoate

Systemtic Name: (4-propan-2-ylphenyl)methyl 2-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]ethanoate Openeye Name: (4-isopropylphenyl)methyl 2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetate CAS Name: 2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetic acid (4-propan-2-ylphenyl)methyl ester IUPAC Name: (4-propan-2-ylphenyl)methyl 2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetate Traditional Name: 2-(1,1,3-triketo-1,2-benzothiazol-2-yl)acetic acid (4-isopropylbenzyl) ester Formula: C19H19NO5S MolecularWeight: 373.42286

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)COC(=O)CN2C(=O)C3=CC=CC=C3S2(=O)=O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)COC(=O)CN2C(=O)C3=CC=CC=C3S2(=O)=O

InChI

InChI=1S/C19H19NO5S/c1-13(2)15-9-7-14(8-10-15)12-25-18(21)11-20-19(22)16-5-3-4-6-17(16)26(20,23)24/h3-10,13H,11-12H2,1-2H3