methyl 2-acetamido-6-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxidanylidene-1,3-thiazolidin-3-yl]hexanoate

Systemtic Name: methyl 2-acetamido-6-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxidanylidene-1,3-thiazolidin-3-yl]hexanoate Openeye Name: methyl 2-acetamido-6-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxo-thiazolidin-3-yl]hexanoate CAS Name: 2-acetamido-6-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxo-3-thiazolidinyl]hexanoic acid methyl ester IUPAC Name: methyl 2-acetamido-6-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxo-1,3-thiazolidin-3-yl]hexanoate Traditional Name: 2-acetamido-6-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-keto-thiazolidin-3-yl]hexanoic acid methyl ester Formula: C20H26N2O6S MolecularWeight: 422.49524

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CCCCN1C(SCC1=O)C2=CC3=C(C=C2)OCCO3)C(=O)OC

Isomeric SMILES

CC(=O)NC(CCCCN1C(SCC1=O)C2=CC3=C(C=C2)OCCO3)C(=O)OC

InChI

InChI=1S/C20H26N2O6S/c1-13(23)21-15(20(25)26-2)5-3-4-8-22-18(24)12-29-19(22)14-6-7-16-17(11-14)28-10-9-27-16/h6-7,11,15,19H,3-5,8-10,12H2,1-2H3,(H,21,23)