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

Systemtic Name: dimethyl 5-azanyl-3-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyloxymethyl)thiophene-2,4-dicarboxylate Openeye Name: dimethyl 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 dimethyl ester IUPAC Name: dimethyl 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 dimethyl ester Formula: C18H17NO8S MolecularWeight: 407.39448

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(=C1COC(=O)C2=CC3=C(C=C2)OCCO3)C(=O)OC)N

Isomeric SMILES

COC(=O)C1=C(SC(=C1COC(=O)C2=CC3=C(C=C2)OCCO3)C(=O)OC)N

InChI

InChI=1S/C18H17NO8S/c1-23-17(21)13-10(14(18(22)24-2)28-15(13)19)8-27-16(20)9-3-4-11-12(7-9)26-6-5-25-11/h3-4,7H,5-6,8,19H2,1-2H3