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

Systemtic Name: dimethyl 5-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]carbonylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: dimethyl 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 dimethyl ester IUPAC Name: dimethyl 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 dimethyl ester Formula: C18H17NO7S MolecularWeight: 391.39508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)C2COC3=CC=CC=C3O2)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)[C@H]2COC3=CC=CC=C3O2)C(=O)OC

InChI

InChI=1S/C18H17NO7S/c1-9-13(17(21)23-2)16(27-14(9)18(22)24-3)19-15(20)12-8-25-10-6-4-5-7-11(10)26-12/h4-7,12H,8H2,1-3H3,(H,19,20)/t12-/m1/s1