diethyl 5-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]carbonylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 5-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]carbonylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-[[(3R)-2,3-dihydro-1,4-benzodioxine-3-carbonyl]amino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]-oxomethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[[(3R)-2,3-dihydro-1,4-benzodioxine-3-carbonyl]amino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-carbonyl]amino]-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C20H21NO7S MolecularWeight: 419.44824

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C2COC3=CC=CC=C3O2

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)[C@H]2COC3=CC=CC=C3O2

InChI

InChI=1S/C20H21NO7S/c1-4-25-19(23)15-11(3)16(20(24)26-5-2)29-18(15)21-17(22)14-10-27-12-8-6-7-9-13(12)28-14/h6-9,14H,4-5,10H2,1-3H3,(H,21,22)/t14-/m1/s1