(2-thiophen-2-yl-1,3-thiazol-4-yl)methyl 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)propanoate

Systemtic Name: (2-thiophen-2-yl-1,3-thiazol-4-yl)methyl 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)propanoate Openeye Name: [2-(2-thienyl)thiazol-4-yl]methyl 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)propanoate CAS Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)propanoic acid (2-thiophen-2-yl-4-thiazolyl)methyl ester IUPAC Name: (2-thiophen-2-yl-1,3-thiazol-4-yl)methyl 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)propanoate Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)propionic acid [2-(2-thienyl)thiazol-4-yl]methyl ester Formula: C19H17NO6S3 MolecularWeight: 451.53638

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)S(=O)(=O)CCC(=O)OCC3=CSC(=N3)C4=CC=CS4

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)S(=O)(=O)CCC(=O)OCC3=CSC(=N3)C4=CC=CS4

InChI

InChI=1S/C19H17NO6S3/c21-18(26-11-13-12-28-19(20-13)17-2-1-8-27-17)5-9-29(22,23)14-3-4-15-16(10-14)25-7-6-24-15/h1-4,8,10,12H,5-7,9,11H2