diethyl 5-azanyl-3-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyloxymethyl)thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 5-azanyl-3-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyloxymethyl)thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-amino-3-(2,3-dihydro-1,4-benzodioxine-6-carbonyloxymethyl)thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-[[2,3-dihydro-1,4-benzodioxin-6-yl(oxo)methoxy]methyl]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-amino-3-(2,3-dihydro-1,4-benzodioxine-6-carbonyloxymethyl)thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-(2,3-dihydro-1,4-benzodioxin-6-carbonyloxymethyl)thiophene-2,4-dicarboxylic acid diethyl ester Formula: C20H21NO8S MolecularWeight: 435.44764

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1COC(=O)C2=CC3=C(C=C2)OCCO3)C(=O)OCC)N

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1COC(=O)C2=CC3=C(C=C2)OCCO3)C(=O)OCC)N

InChI

InChI=1S/C20H21NO8S/c1-3-25-19(23)15-12(16(30-17(15)21)20(24)26-4-2)10-29-18(22)11-5-6-13-14(9-11)28-8-7-27-13/h5-6,9H,3-4,7-8,10,21H2,1-2H3